Jang, Kyoung-Soon; Park, Ki-Tae (2019): (Supplement S2) Chemical characteristics of the assigned elemental formulas from the FT-ICR MS data of Arctic aerosol-derived organic matter collected in Ny-Ålesund, 02-05 May [dataset]. PANGAEA, https://doi.org/10.1594/PANGAEA.905589, In supplement to: Choi, J H; Jang, E; Yoon, Y J; Park, Jae Yeon; Kim, T-W; Becagli, Silvia; Caiazzo, L; Cappelletti, David; Krejci, Radovan; Eleftheriadis, Konstantinos; Park, Ki-Tae; Jang, Kyoung-Soon (2019): Influence of biogenic organics on the chemical composition of Arctic aerosols. Global Biogeochemical Cycles, 33(10), 1238-1250, https://doi.org/10.1029/2019GB006226
Always quote citation above when using data! You can download the citation in several formats below.
Coverage:
Latitude: 78.925600 * Longitude: 11.937700
Date/Time Start: 2015-05-02T00:00:00 * Date/Time End: 2015-05-05T00:00:00
Event(s):
Parameter(s):
| # | Name | Short Name | Unit | Principal Investigator | Method/Device | Comment |
|---|---|---|---|---|---|---|
| 1 | DATE/TIME | Date/Time | Jang, Kyoung-Soon | Geocode – start | ||
| 2 | DATE/TIME | Date/Time | Jang, Kyoung-Soon | Geocode – end | ||
| 3 | Molecular formula | Formula | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | ||
| 4 | Method comment | Method comm | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | adduct | |
| 5 | Mass-to-charge ratio | m/z | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | experimentally observed (Expt) | |
| 6 | Intensity | Intensity | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | mono | |
| 7 | Intensity | Intensity | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | total | |
| 8 | Mass-to-charge ratio | m/z | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | calculated (Calc) | |
| 9 | Error | Error | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | difference between m/z (Calc) and m/z (Expt) in parts per million | |
| 10 | Charge | Charge | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | ||
| 11 | Double bond equivalent | DBE | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | ||
| 12 | Oxygen/Carbon ratio | O/C | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | ||
| 13 | Hydrogen/Carbon ratio | H/C | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | ||
| 14 | Nitrogen/Carbon ratio | N/C | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | ||
| 15 | Sulfur/Carbon ratio | S/C | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | ||
| 16 | Aromaticity index | AI | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) | ||
| 17 | Class | Class | Jang, Kyoung-Soon | 15 Tesla Fourier transform ion cyclotron resonance mass spectrometer (15T FT-ICR MS) |
License:
Creative Commons Attribution 4.0 International (CC-BY-4.0)
Size:
9121 data points
Data
| 1 Date/Time (start) | 2 Date/Time (end) | 3 Formula | 4 Method comm (adduct) | 5 m/z (experimentally observed (Expt)) | 6 Intensity (mono) | 7 Intensity (total) | 8 m/z (calculated (Calc)) | 9 Error (difference between m/z (Calc)...) | 10 Charge | 11 DBE | 12 O/C | 13 H/C | 14 N/C | 15 S/C | 16 AI | 17 Class |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 2015-05-02 | 2015-05-05 | C17H27N5S | H | 332.191518 | 5220131 | 5220131.00 | 332.191440 | 0.2344 | -1 | 7 | 0.00 | 1.59 | 0.294 | 0.059 | 0.32 | CHNS |
| 2015-05-02 | 2015-05-05 | C19H19N5O | H | 332.151637 | 9389829 | 9389829.00 | 332.151684 | -0.1409 | -1 | 13 | 0.05 | 1.00 | 0.263 | 0.000 | 0.73 | CHON |
| 2015-05-02 | 2015-05-05 | C18H27N3OS | H | 332.180157 | 4761371 | 4761371.00 | 332.180207 | -0.1497 | -1 | 7 | 0.06 | 1.50 | 0.167 | 0.056 | 0.27 | CHONS |
| 2015-05-02 | 2015-05-05 | C14H22O | H | 205.159794 | 10975920 | 10975920.00 | 205.159789 | 0.0250 | -1 | 4 | 0.07 | 1.57 | 0.000 | 0.000 | 0.23 | CHO |
| 2015-05-02 | 2015-05-05 | C22H31NO2 | H | 340.228224 | 5983736 | 5983736.00 | 340.228203 | 0.0623 | -1 | 8 | 0.09 | 1.41 | 0.045 | 0.000 | 0.29 | CHON |
| 2015-05-02 | 2015-05-05 | C19H28O2 | H | 287.201636 | 4872357 | 4872357.00 | 287.201654 | -0.0616 | -1 | 6 | 0.11 | 1.47 | 0.000 | 0.000 | 0.24 | CHO |
| 2015-05-02 | 2015-05-05 | C19H30O2 | H | 289.217285 | 5244985 | 5244985.00 | 289.217304 | -0.0648 | -1 | 5 | 0.11 | 1.58 | 0.000 | 0.000 | 0.18 | CHO |
| 2015-05-02 | 2015-05-05 | C18H24O2 | H | 271.170366 | 4941022 | 4941022.00 | 271.170354 | 0.0459 | -1 | 7 | 0.11 | 1.33 | 0.000 | 0.000 | 0.31 | CHO |
| 2015-05-02 | 2015-05-05 | C27H44O3 | H | 415.321779 | 4794395 | 4794395.00 | 415.321769 | 0.0245 | -1 | 6 | 0.11 | 1.63 | 0.000 | 0.000 | 0.13 | CHO |
| 2015-05-02 | 2015-05-05 | C18H28O2 | H | 275.201662 | 4321563 | 4321563.00 | 275.201654 | 0.0302 | -1 | 5 | 0.11 | 1.56 | 0.000 | 0.000 | 0.19 | CHO |
| 2015-05-02 | 2015-05-05 | C18H36O2 | H | 283.264248 | 560104064 | 678359131.90 | 283.264254 | -0.0210 | -1 | 1 | 0.11 | 2.00 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H25NO2 | H | 274.181253 | 10066447 | 10066447.00 | 274.181253 | 0.0015 | -1 | 6 | 0.12 | 1.47 | 0.059 | 0.000 | 0.25 | CHON |
| 2015-05-02 | 2015-05-05 | C17H29NO2 | H | 278.212545 | 4890208 | 4890208.00 | 278.212553 | -0.0278 | -1 | 4 | 0.12 | 1.71 | 0.059 | 0.000 | 0.11 | CHON |
| 2015-05-02 | 2015-05-05 | C24H49NO3S | H | 430.336063 | 9286853 | 9286853.00 | 430.336039 | 0.0565 | -1 | 1 | 0.13 | 2.04 | 0.042 | 0.042 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C16H25NO2 | H | 262.181262 | 4162425 | 4162425.00 | 262.181253 | 0.0359 | -1 | 5 | 0.13 | 1.56 | 0.063 | 0.000 | 0.19 | CHON |
| 2015-05-02 | 2015-05-05 | C16H30O2 | H | 253.217310 | 46191480 | 46191480.00 | 253.217304 | 0.0247 | -1 | 2 | 0.13 | 1.88 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C24H31NO3 | H | 380.223093 | 4915050 | 4915050.00 | 380.223117 | -0.0642 | -1 | 10 | 0.13 | 1.29 | 0.042 | 0.000 | 0.33 | CHON |
| 2015-05-02 | 2015-05-05 | C23H32O3 | H | 355.227847 | 4828620 | 4828620.00 | 355.227868 | -0.0604 | -1 | 8 | 0.13 | 1.39 | 0.000 | 0.000 | 0.25 | CHO |
| 2015-05-02 | 2015-05-05 | C15H25NO2 | H | 250.181265 | 4092180 | 4092180.00 | 250.181253 | 0.0496 | -1 | 4 | 0.13 | 1.67 | 0.067 | 0.000 | 0.13 | CHON |
| 2015-05-02 | 2015-05-05 | C22H36O3 | H | 347.259189 | 5140279 | 5140279.00 | 347.259169 | 0.0588 | -1 | 5 | 0.14 | 1.64 | 0.000 | 0.000 | 0.11 | CHO |
| 2015-05-02 | 2015-05-05 | C22H30O3 | H | 341.212229 | 7499923 | 7499923.00 | 341.212218 | 0.0311 | -1 | 8 | 0.14 | 1.36 | 0.000 | 0.000 | 0.26 | CHO |
| 2015-05-02 | 2015-05-05 | C22H32O3 | H | 343.227860 | 6559164 | 6559164.00 | 343.227868 | -0.0246 | -1 | 7 | 0.14 | 1.45 | 0.000 | 0.000 | 0.21 | CHO |
| 2015-05-02 | 2015-05-05 | C22H34O3 | H | 345.243492 | 4450976 | 4450976.00 | 345.243519 | -0.0768 | -1 | 6 | 0.14 | 1.55 | 0.000 | 0.000 | 0.16 | CHO |
| 2015-05-02 | 2015-05-05 | C21H29NO3 | H | 342.207497 | 4567847 | 4567847.00 | 342.207467 | 0.0866 | -1 | 8 | 0.14 | 1.38 | 0.048 | 0.000 | 0.26 | CHON |
| 2015-05-02 | 2015-05-05 | C21H33NO3 | H | 346.238787 | 4562159 | 4562159.00 | 346.238767 | 0.0564 | -1 | 6 | 0.14 | 1.57 | 0.048 | 0.000 | 0.15 | CHON |
| 2015-05-02 | 2015-05-05 | C21H32O3 | H | 331.227875 | 6202439 | 6202439.00 | 331.227868 | 0.0198 | -1 | 6 | 0.14 | 1.52 | 0.000 | 0.000 | 0.17 | CHO |
| 2015-05-02 | 2015-05-05 | C21H30O3 | H | 329.212222 | 9059906 | 9059906.00 | 329.212218 | 0.0110 | -1 | 7 | 0.14 | 1.43 | 0.000 | 0.000 | 0.22 | CHO |
| 2015-05-02 | 2015-05-05 | C27H52O4 | H | 439.379284 | 4560900 | 4560900.00 | 439.379284 | 0.0007 | -1 | 2 | 0.15 | 1.93 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H32O3 | H | 319.227877 | 8659152 | 8659152.00 | 319.227868 | 0.0268 | -1 | 5 | 0.15 | 1.60 | 0.000 | 0.000 | 0.12 | CHO |
| 2015-05-02 | 2015-05-05 | C20H41NO3S | H | 374.273439 | 9092495 | 9092495.00 | 374.273438 | 0.0015 | -1 | 1 | 0.15 | 2.05 | 0.050 | 0.050 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C20H26O3 | H | 313.180909 | 10117261 | 10117261.00 | 313.180918 | -0.0295 | -1 | 8 | 0.15 | 1.30 | 0.000 | 0.000 | 0.29 | CHO |
| 2015-05-02 | 2015-05-05 | C13H22O2 | H | 209.154711 | 15572305 | 15572305.00 | 209.154703 | 0.0359 | -1 | 3 | 0.15 | 1.69 | 0.000 | 0.000 | 0.09 | CHO |
| 2015-05-02 | 2015-05-05 | C19H29NO3S | H | 350.179551 | 8406336 | 8406336.00 | 350.179538 | 0.0370 | -1 | 6 | 0.16 | 1.53 | 0.053 | 0.053 | 0.11 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H30O3 | H | 305.212219 | 11726556 | 11726556.00 | 305.212218 | 0.0020 | -1 | 5 | 0.16 | 1.58 | 0.000 | 0.000 | 0.13 | CHO |
| 2015-05-02 | 2015-05-05 | C19H29NO3 | H | 318.207466 | 6856178 | 6856178.00 | 318.207467 | -0.0042 | -1 | 6 | 0.16 | 1.53 | 0.053 | 0.000 | 0.17 | CHON |
| 2015-05-02 | 2015-05-05 | C19H31NO3 | H | 320.223116 | 6140839 | 6140839.00 | 320.223117 | -0.0044 | -1 | 5 | 0.16 | 1.63 | 0.053 | 0.000 | 0.10 | CHON |
| 2015-05-02 | 2015-05-05 | C19H27NO3 | H | 316.191814 | 5113962 | 5113962.00 | 316.191817 | -0.0104 | -1 | 7 | 0.16 | 1.42 | 0.053 | 0.000 | 0.23 | CHON |
| 2015-05-02 | 2015-05-05 | C19H31NO3S | H | 352.195181 | 15649011 | 15649011.00 | 352.195188 | -0.0202 | -1 | 5 | 0.16 | 1.63 | 0.053 | 0.053 | 0.04 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H33NO3S | H | 354.210831 | 13175875 | 13175875.00 | 354.210838 | -0.0202 | -1 | 4 | 0.16 | 1.74 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H36N2O3 | H | 339.265309 | 5512030 | 5512030.00 | 339.265317 | -0.0223 | -1 | 3 | 0.16 | 1.89 | 0.105 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H24O3 | H | 299.165259 | 5490049 | 5490049.00 | 299.165268 | -0.0307 | -1 | 8 | 0.16 | 1.26 | 0.000 | 0.000 | 0.31 | CHO |
| 2015-05-02 | 2015-05-05 | C19H28O3 | H | 303.196559 | 7949131 | 7949131.00 | 303.196568 | -0.0307 | -1 | 6 | 0.16 | 1.47 | 0.000 | 0.000 | 0.19 | CHO |
| 2015-05-02 | 2015-05-05 | C19H32O3S | H | 339.199921 | 1219160832 | 1556455217.00 | 339.199939 | -0.0535 | -1 | 4 | 0.16 | 1.68 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H24O3 | H | 287.165286 | 5931176 | 5931176.00 | 287.165268 | 0.0620 | -1 | 7 | 0.17 | 1.33 | 0.000 | 0.000 | 0.27 | CHO |
| 2015-05-02 | 2015-05-05 | C18H25NO3 | H | 302.176179 | 4209063 | 4209063.00 | 302.176167 | 0.0390 | -1 | 7 | 0.17 | 1.39 | 0.056 | 0.000 | 0.25 | CHON |
| 2015-05-02 | 2015-05-05 | C24H38O4 | H | 389.269745 | 4456904 | 4456904.00 | 389.269733 | 0.0302 | -1 | 6 | 0.17 | 1.58 | 0.000 | 0.000 | 0.10 | CHO |
| 2015-05-02 | 2015-05-05 | C18H27NO3S | H | 336.163896 | 8282805 | 8282805.00 | 336.163888 | 0.0239 | -1 | 6 | 0.17 | 1.50 | 0.056 | 0.056 | 0.12 | CHONS |
| 2015-05-02 | 2015-05-05 | C24H43NO4 | H | 408.311939 | 5746229 | 5746229.00 | 408.311932 | 0.0161 | -1 | 4 | 0.17 | 1.79 | 0.042 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H27NO3 | H | 304.191815 | 5432576 | 5432576.00 | 304.191817 | -0.0075 | -1 | 6 | 0.17 | 1.50 | 0.056 | 0.000 | 0.18 | CHON |
| 2015-05-02 | 2015-05-05 | C18H29NO3S | H | 338.179526 | 22587490 | 22587490.00 | 338.179538 | -0.0356 | -1 | 5 | 0.17 | 1.61 | 0.056 | 0.056 | 0.04 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H30O3S | H | 325.184277 | 1444594176 | 1831420541.00 | 325.184289 | -0.0371 | -1 | 4 | 0.17 | 1.67 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H29NO3 | H | 306.207454 | 9117893 | 9117893.00 | 306.207467 | -0.0436 | -1 | 5 | 0.17 | 1.61 | 0.056 | 0.000 | 0.11 | CHON |
| 2015-05-02 | 2015-05-05 | C18H34N2O3 | H | 325.249653 | 5403237 | 5403237.00 | 325.249667 | -0.0416 | -1 | 3 | 0.17 | 1.89 | 0.111 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C23H32O4 | H | 371.222782 | 4734020 | 4734020.00 | 371.222783 | -0.0029 | -1 | 8 | 0.17 | 1.39 | 0.000 | 0.000 | 0.21 | CHO |
| 2015-05-02 | 2015-05-05 | C23H34O4 | H | 373.238410 | 4980007 | 4980007.00 | 373.238433 | -0.0620 | -1 | 7 | 0.17 | 1.48 | 0.000 | 0.000 | 0.16 | CHO |
| 2015-05-02 | 2015-05-05 | C23H41NO4 | H | 394.296249 | 5022611 | 5022611.00 | 394.296282 | -0.0846 | -1 | 4 | 0.17 | 1.78 | 0.043 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C23H40O4 | H | 379.285347 | 4472617 | 4472617.00 | 379.285383 | -0.0958 | -1 | 4 | 0.17 | 1.74 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H25NO3S | H | 322.148277 | 4497722 | 4497722.00 | 322.148238 | 0.1213 | -1 | 6 | 0.18 | 1.47 | 0.059 | 0.059 | 0.13 | CHONS |
| 2015-05-02 | 2015-05-05 | C17H27NO3S | H | 324.163892 | 12517162 | 12517162.00 | 324.163888 | 0.0124 | -1 | 5 | 0.18 | 1.59 | 0.059 | 0.059 | 0.04 | CHONS |
| 2015-05-02 | 2015-05-05 | C17H32N2O3 | H | 311.234008 | 5454789 | 5454789.00 | 311.234016 | -0.0272 | -1 | 3 | 0.18 | 1.88 | 0.118 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C17H34N2O3 | H | 313.249653 | 7692473 | 7692473.00 | 313.249667 | -0.0431 | -1 | 2 | 0.18 | 2.00 | 0.118 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C17H28O3S | H | 311.168624 | 1179294592 | 1467358272.00 | 311.168639 | -0.0482 | -1 | 4 | 0.18 | 1.65 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C22H32O4 | H | 359.222816 | 5477116 | 5477116.00 | 359.222783 | 0.0917 | -1 | 7 | 0.18 | 1.45 | 0.000 | 0.000 | 0.17 | CHO |
| 2015-05-02 | 2015-05-05 | C22H35NO4 | H | 376.249360 | 4436545 | 4436545.00 | 376.249332 | 0.0740 | -1 | 6 | 0.18 | 1.59 | 0.045 | 0.000 | 0.09 | CHON |
| 2015-05-02 | 2015-05-05 | C22H33NO4 | H | 374.233707 | 4631947 | 4631947.00 | 374.233682 | 0.0665 | -1 | 7 | 0.18 | 1.50 | 0.045 | 0.000 | 0.15 | CHON |
| 2015-05-02 | 2015-05-05 | C22H38O4 | H | 365.269746 | 7854249 | 7854249.00 | 365.269733 | 0.0349 | -1 | 4 | 0.18 | 1.73 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H34O4 | H | 361.238428 | 7550245 | 7550245.00 | 361.238433 | -0.0142 | -1 | 6 | 0.18 | 1.55 | 0.000 | 0.000 | 0.11 | CHO |
| 2015-05-02 | 2015-05-05 | C22H39NO4 | H | 380.280595 | 4673390 | 4673390.00 | 380.280632 | -0.0981 | -1 | 4 | 0.18 | 1.77 | 0.045 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C22H36O4 | H | 363.254039 | 5523207 | 5523207.00 | 363.254083 | -0.1217 | -1 | 5 | 0.18 | 1.64 | 0.000 | 0.000 | 0.06 | CHO |
| 2015-05-02 | 2015-05-05 | C16H23NO3 | H | 276.160528 | 4216888 | 4216888.00 | 276.160517 | 0.0393 | -1 | 6 | 0.19 | 1.44 | 0.063 | 0.000 | 0.21 | CHON |
| 2015-05-02 | 2015-05-05 | C21H37NO4 | H | 366.265003 | 7068002 | 7068002.00 | 366.264982 | 0.0567 | -1 | 4 | 0.19 | 1.76 | 0.048 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C21H34O4 | H | 349.238448 | 6288228 | 6288228.00 | 349.238433 | 0.0426 | -1 | 5 | 0.19 | 1.62 | 0.000 | 0.000 | 0.06 | CHO |
| 2015-05-02 | 2015-05-05 | C21H35NO4 | H | 364.249347 | 5253085 | 5253085.00 | 364.249332 | 0.0407 | -1 | 5 | 0.19 | 1.67 | 0.048 | 0.000 | 0.03 | CHON |
| 2015-05-02 | 2015-05-05 | C21H36O4S | H | 383.226163 | 6537262 | 6537262.00 | 383.226154 | 0.0238 | -1 | 4 | 0.19 | 1.71 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H31NO4 | H | 360.218038 | 7517206 | 7517206.00 | 360.218032 | 0.0166 | -1 | 7 | 0.19 | 1.48 | 0.048 | 0.000 | 0.16 | CHON |
| 2015-05-02 | 2015-05-05 | C21H29NO4 | H | 358.202384 | 5132743 | 5132743.00 | 358.202382 | 0.0057 | -1 | 8 | 0.19 | 1.38 | 0.048 | 0.000 | 0.22 | CHON |
| 2015-05-02 | 2015-05-05 | C21H30O4 | H | 345.207130 | 7248522 | 7248522.00 | 345.207133 | -0.0087 | -1 | 7 | 0.19 | 1.43 | 0.000 | 0.000 | 0.18 | CHO |
| 2015-05-02 | 2015-05-05 | C21H34O4S | H | 381.210497 | 4890540 | 4890540.00 | 381.210504 | -0.0179 | -1 | 5 | 0.19 | 1.62 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H32O4 | H | 347.222773 | 7806754 | 7806754.00 | 347.222783 | -0.0290 | -1 | 6 | 0.19 | 1.52 | 0.000 | 0.000 | 0.12 | CHO |
| 2015-05-02 | 2015-05-05 | C21H33NO4 | H | 362.233671 | 4757019 | 4757019.00 | 362.233682 | -0.0306 | -1 | 6 | 0.19 | 1.57 | 0.048 | 0.000 | 0.09 | CHON |
| 2015-05-02 | 2015-05-05 | C21H28O4 | H | 343.191467 | 5879205 | 5879205.00 | 343.191483 | -0.0464 | -1 | 8 | 0.19 | 1.33 | 0.000 | 0.000 | 0.24 | CHO |
| 2015-05-02 | 2015-05-05 | C25H45NO5 | H | 438.322552 | 5117382 | 5117382.00 | 438.322497 | 0.1252 | -1 | 4 | 0.20 | 1.80 | 0.040 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H38N2O4 | H | 369.275914 | 5745475 | 5745475.00 | 369.275881 | 0.0886 | -1 | 3 | 0.20 | 1.90 | 0.100 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C25H47NO5 | H | 440.338175 | 4569611 | 4569611.00 | 440.338147 | 0.0632 | -1 | 3 | 0.20 | 1.88 | 0.040 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H31NO4S | H | 380.190113 | 7479144 | 7479144.00 | 380.190103 | 0.0270 | -1 | 6 | 0.20 | 1.55 | 0.050 | 0.050 | 0.04 | CHONS |
| 2015-05-02 | 2015-05-05 | C15H26O3 | H | 253.180928 | 8287091 | 8287091.00 | 253.180918 | 0.0385 | -1 | 3 | 0.20 | 1.73 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H30O4S | H | 365.179212 | 8542359 | 8542359.00 | 365.179204 | 0.0228 | -1 | 6 | 0.20 | 1.50 | 0.000 | 0.050 | 0.07 | CHOS |
| 2015-05-02 | 2015-05-05 | C20H35NO4S | H | 384.221409 | 11706477 | 11706477.00 | 384.221403 | 0.0160 | -1 | 4 | 0.20 | 1.75 | 0.050 | 0.050 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C15H25NO3 | H | 266.176173 | 6299917 | 6299917.00 | 266.176167 | 0.0217 | -1 | 4 | 0.20 | 1.67 | 0.067 | 0.000 | 0.05 | CHON |
| 2015-05-02 | 2015-05-05 | C20H40O4S | H | 375.257459 | 7192043 | 7192043.00 | 375.257454 | 0.0133 | -1 | 1 | 0.20 | 2.00 | 0.000 | 0.050 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C25H46O5 | H | 425.327252 | 6630002 | 6630002.00 | 425.327248 | 0.0091 | -1 | 3 | 0.20 | 1.84 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H36N2O4 | H | 367.260235 | 4688397 | 4688397.00 | 367.260231 | 0.0103 | -1 | 4 | 0.20 | 1.80 | 0.100 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H27NO4 | H | 344.186734 | 6633497 | 6633497.00 | 344.186732 | 0.0061 | -1 | 8 | 0.20 | 1.35 | 0.050 | 0.000 | 0.23 | CHON |
| 2015-05-02 | 2015-05-05 | C20H28O4 | H | 331.191483 | 8836139 | 8836139.00 | 331.191483 | 0.0002 | -1 | 7 | 0.20 | 1.40 | 0.000 | 0.000 | 0.19 | CHO |
| 2015-05-02 | 2015-05-05 | C20H33NO4S | H | 382.205751 | 18620396 | 18620396.00 | 382.205753 | -0.0047 | -1 | 5 | 0.20 | 1.65 | 0.050 | 0.050 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C25H42O5 | H | 421.295946 | 4698776 | 4698776.00 | 421.295948 | -0.0048 | -1 | 5 | 0.20 | 1.68 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H35NO4 | H | 352.249328 | 9799947 | 9799947.00 | 352.249332 | -0.0118 | -1 | 4 | 0.20 | 1.75 | 0.050 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H29NO4 | H | 346.202374 | 10206425 | 10206425.00 | 346.202382 | -0.0230 | -1 | 7 | 0.20 | 1.45 | 0.050 | 0.000 | 0.17 | CHON |
| 2015-05-02 | 2015-05-05 | C20H33NO4 | H | 350.233668 | 7882075 | 7882075.00 | 350.233682 | -0.0403 | -1 | 5 | 0.20 | 1.65 | 0.050 | 0.000 | 0.03 | CHON |
| 2015-05-02 | 2015-05-05 | C20H26O4 | H | 329.175814 | 7757350 | 7757350.00 | 329.175833 | -0.0573 | -1 | 8 | 0.20 | 1.30 | 0.000 | 0.000 | 0.25 | CHO |
| 2015-05-02 | 2015-05-05 | C20H31NO4 | H | 348.218006 | 7643464 | 7643464.00 | 348.218032 | -0.0748 | -1 | 6 | 0.20 | 1.55 | 0.050 | 0.000 | 0.10 | CHON |
| 2015-05-02 | 2015-05-05 | C24H31NO5 | H | 412.212982 | 6853465 | 6853465.00 | 412.212947 | 0.0857 | -1 | 10 | 0.21 | 1.29 | 0.042 | 0.000 | 0.25 | CHON |
| 2015-05-02 | 2015-05-05 | C24H46O5 | H | 413.327267 | 5272829 | 5272829.00 | 413.327248 | 0.0456 | -1 | 2 | 0.21 | 1.92 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C24H44O5 | H | 411.311610 | 7533075 | 7533075.00 | 411.311598 | 0.0290 | -1 | 3 | 0.21 | 1.83 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C24H45NO5 | H | 426.322499 | 7031924 | 7031924.00 | 426.322497 | 0.0044 | -1 | 3 | 0.21 | 1.88 | 0.042 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C24H38O5 | H | 405.264628 | 10742508 | 10742508.00 | 405.264648 | -0.0490 | -1 | 6 | 0.21 | 1.58 | 0.000 | 0.000 | 0.05 | CHO |
| 2015-05-02 | 2015-05-05 | C19H27NO4 | H | 332.186753 | 7755552 | 7755552.00 | 332.186732 | 0.0635 | -1 | 7 | 0.21 | 1.42 | 0.053 | 0.000 | 0.18 | CHON |
| 2015-05-02 | 2015-05-05 | C19H29NO4 | H | 334.202386 | 6982924 | 6982924.00 | 334.202382 | 0.0121 | -1 | 6 | 0.21 | 1.53 | 0.053 | 0.000 | 0.11 | CHON |
| 2015-05-02 | 2015-05-05 | C19H33NO4S | H | 370.205756 | 19913666 | 24005901.33 | 370.205753 | 0.0087 | -1 | 4 | 0.21 | 1.74 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H30O4 | H | 321.207136 | 14956156 | 14956156.00 | 321.207133 | 0.0093 | -1 | 5 | 0.21 | 1.58 | 0.000 | 0.000 | 0.07 | CHO |
| 2015-05-02 | 2015-05-05 | C19H28O4S | H | 351.163555 | 17631004 | 17631004.00 | 351.163554 | 0.0039 | -1 | 6 | 0.21 | 1.47 | 0.000 | 0.053 | 0.07 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H29NO4S | H | 366.174453 | 12597585 | 12597585.00 | 366.174453 | 0.0009 | -1 | 6 | 0.21 | 1.53 | 0.053 | 0.053 | 0.04 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H25NO4 | H | 330.171080 | 5976352 | 5976352.00 | 330.171082 | -0.0056 | -1 | 8 | 0.21 | 1.32 | 0.053 | 0.000 | 0.25 | CHON |
| 2015-05-02 | 2015-05-05 | C19H24O4 | H | 315.160179 | 10380713 | 10380713.00 | 315.160183 | -0.0121 | -1 | 8 | 0.21 | 1.26 | 0.000 | 0.000 | 0.27 | CHO |
| 2015-05-02 | 2015-05-05 | C19H28O4 | H | 319.191477 | 15921334 | 15921334.00 | 319.191483 | -0.0186 | -1 | 6 | 0.21 | 1.47 | 0.000 | 0.000 | 0.13 | CHO |
| 2015-05-02 | 2015-05-05 | C19H35NO4S | H | 372.221393 | 5016761 | 5016761.00 | 372.221403 | -0.0265 | -1 | 3 | 0.21 | 1.84 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H33NO4 | H | 338.233670 | 10250376 | 10250376.00 | 338.233682 | -0.0358 | -1 | 4 | 0.21 | 1.74 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H38N2O4 | H | 357.275869 | 4862110 | 4862110.00 | 357.275881 | -0.0343 | -1 | 2 | 0.21 | 2.00 | 0.105 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H22O4 | H | 313.144519 | 4817014 | 4817014.00 | 313.144533 | -0.0439 | -1 | 9 | 0.21 | 1.16 | 0.000 | 0.000 | 0.33 | CHO |
| 2015-05-02 | 2015-05-05 | C19H31NO4 | H | 336.218015 | 6857437 | 6857437.00 | 336.218032 | -0.0507 | -1 | 5 | 0.21 | 1.63 | 0.053 | 0.000 | 0.04 | CHON |
| 2015-05-02 | 2015-05-05 | C19H26O4 | H | 317.175811 | 9759511 | 9759511.00 | 317.175833 | -0.0690 | -1 | 7 | 0.21 | 1.37 | 0.000 | 0.000 | 0.20 | CHO |
| 2015-05-02 | 2015-05-05 | C19H34N2O4 | H | 353.244552 | 5124793 | 5124793.00 | 353.244581 | -0.0825 | -1 | 4 | 0.21 | 1.79 | 0.105 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C14H23NO3 | H | 252.160527 | 4659917 | 4659917.00 | 252.160517 | 0.0390 | -1 | 4 | 0.21 | 1.64 | 0.071 | 0.000 | 0.05 | CHON |
| 2015-05-02 | 2015-05-05 | C14H20O3 | H | 235.133972 | 4183758 | 4183758.00 | 235.133968 | 0.0168 | -1 | 5 | 0.21 | 1.43 | 0.000 | 0.000 | 0.18 | CHO |
| 2015-05-02 | 2015-05-05 | C14H21NO3 | H | 250.144871 | 24490250 | 24490250.00 | 250.144867 | 0.0156 | -1 | 5 | 0.21 | 1.50 | 0.071 | 0.000 | 0.15 | CHON |
| 2015-05-02 | 2015-05-05 | C23H35NO5 | H | 404.244282 | 4491766 | 4491766.00 | 404.244247 | 0.0871 | -1 | 7 | 0.22 | 1.52 | 0.043 | 0.000 | 0.09 | CHON |
| 2015-05-02 | 2015-05-05 | C23H36O5 | H | 391.249032 | 6414953 | 6414953.00 | 391.248998 | 0.0874 | -1 | 6 | 0.22 | 1.57 | 0.000 | 0.000 | 0.06 | CHO |
| 2015-05-02 | 2015-05-05 | C23H44O5 | H | 399.311623 | 6309427 | 6309427.00 | 399.311598 | 0.0624 | -1 | 2 | 0.22 | 1.91 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H38O5 | H | 393.264656 | 5612327 | 5612327.00 | 393.264648 | 0.0207 | -1 | 5 | 0.22 | 1.65 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H31NO5 | H | 400.212953 | 16131786 | 16131786.00 | 400.212947 | 0.0158 | -1 | 9 | 0.22 | 1.35 | 0.043 | 0.000 | 0.21 | CHON |
| 2015-05-02 | 2015-05-05 | C23H32O5 | H | 387.217700 | 4731186 | 4731186.00 | 387.217698 | 0.0060 | -1 | 8 | 0.22 | 1.39 | 0.000 | 0.000 | 0.17 | CHO |
| 2015-05-02 | 2015-05-05 | C23H34O5 | H | 389.233340 | 6111685 | 6111685.00 | 389.233348 | -0.0199 | -1 | 7 | 0.22 | 1.48 | 0.000 | 0.000 | 0.11 | CHO |
| 2015-05-02 | 2015-05-05 | C23H42O5 | H | 397.295935 | 9331973 | 9331973.00 | 397.295948 | -0.0327 | -1 | 3 | 0.22 | 1.83 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H41NO5 | H | 410.291182 | 5443761 | 5443761.00 | 410.291197 | -0.0365 | -1 | 4 | 0.22 | 1.78 | 0.043 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C23H40O5 | H | 395.280279 | 6267907 | 6267907.00 | 395.280298 | -0.0479 | -1 | 4 | 0.22 | 1.74 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H32O4S | H | 343.194867 | 14669222 | 14669222.00 | 343.194854 | 0.0386 | -1 | 3 | 0.22 | 1.78 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H23NO4 | H | 316.155442 | 4896849 | 4896849.00 | 316.155432 | 0.0323 | -1 | 8 | 0.22 | 1.28 | 0.056 | 0.000 | 0.27 | CHON |
| 2015-05-02 | 2015-05-05 | C18H27NO4 | H | 320.186740 | 9229196 | 9229196.00 | 320.186732 | 0.0253 | -1 | 6 | 0.22 | 1.50 | 0.056 | 0.000 | 0.12 | CHON |
| 2015-05-02 | 2015-05-05 | C18H32N2O4 | H | 339.228937 | 6441797 | 6441797.00 | 339.228931 | 0.0175 | -1 | 4 | 0.22 | 1.78 | 0.111 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H29NO4 | H | 322.202387 | 7772515 | 7772515.00 | 322.202382 | 0.0156 | -1 | 5 | 0.22 | 1.61 | 0.056 | 0.000 | 0.04 | CHON |
| 2015-05-02 | 2015-05-05 | C18H34N2O4 | H | 341.244586 | 5972137 | 5972137.00 | 341.244581 | 0.0142 | -1 | 3 | 0.22 | 1.89 | 0.111 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H36O4S | H | 347.226156 | 4587300 | 4587300.00 | 347.226154 | 0.0061 | -1 | 1 | 0.22 | 2.00 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H25NO4 | H | 318.171082 | 6114776 | 6114776.00 | 318.171082 | 0.0005 | -1 | 7 | 0.22 | 1.39 | 0.056 | 0.000 | 0.19 | CHON |
| 2015-05-02 | 2015-05-05 | C18H22O4 | H | 301.144532 | 6727708 | 6727708.00 | 301.144533 | -0.0025 | -1 | 8 | 0.22 | 1.22 | 0.000 | 0.000 | 0.29 | CHO |
| 2015-05-02 | 2015-05-05 | C18H33NO4S | H | 358.205751 | 4870601 | 4870601.00 | 358.205753 | -0.0050 | -1 | 3 | 0.22 | 1.83 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H36N2O4 | H | 343.260228 | 5846481 | 5846481.00 | 343.260231 | -0.0093 | -1 | 2 | 0.22 | 2.00 | 0.111 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H31NO4S | H | 356.190099 | 23269162 | 23269162.00 | 356.190103 | -0.0105 | -1 | 4 | 0.22 | 1.72 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H26O4S | H | 337.147898 | 15484288 | 15484288.00 | 337.147904 | -0.0165 | -1 | 6 | 0.22 | 1.44 | 0.000 | 0.056 | 0.08 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H24O4 | H | 303.160176 | 7412539 | 7412539.00 | 303.160183 | -0.0225 | -1 | 7 | 0.22 | 1.33 | 0.000 | 0.000 | 0.21 | CHO |
| 2015-05-02 | 2015-05-05 | C18H29NO4S | H | 354.174443 | 24300596 | 24300596.00 | 354.174453 | -0.0273 | -1 | 5 | 0.22 | 1.61 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H27NO4S | H | 352.158779 | 7555299 | 7555299.00 | 352.158803 | -0.0670 | -1 | 6 | 0.22 | 1.50 | 0.056 | 0.056 | 0.04 | CHONS |
| 2015-05-02 | 2015-05-05 | C22H36O5 | H | 379.249027 | 8986407 | 8986407.00 | 379.248998 | 0.0770 | -1 | 5 | 0.23 | 1.64 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H32O5 | H | 375.217701 | 7232999 | 7232999.00 | 375.217698 | 0.0088 | -1 | 7 | 0.23 | 1.45 | 0.000 | 0.000 | 0.12 | CHO |
| 2015-05-02 | 2015-05-05 | C22H43NO5S | H | 432.278915 | 6789345 | 6789345.00 | 432.278918 | -0.0063 | -1 | 2 | 0.23 | 1.95 | 0.045 | 0.045 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C22H34O5 | H | 377.233345 | 6930065 | 6930065.00 | 377.233348 | -0.0073 | -1 | 6 | 0.23 | 1.55 | 0.000 | 0.000 | 0.06 | CHO |
| 2015-05-02 | 2015-05-05 | C22H38O5 | H | 381.264643 | 7298991 | 7298991.00 | 381.264648 | -0.0128 | -1 | 4 | 0.23 | 1.73 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H33NO5 | H | 390.228583 | 4575763 | 4575763.00 | 390.228597 | -0.0352 | -1 | 7 | 0.23 | 1.50 | 0.045 | 0.000 | 0.09 | CHON |
| 2015-05-02 | 2015-05-05 | C22H39NO5 | H | 396.275531 | 5571710 | 5571710.00 | 396.275547 | -0.0402 | -1 | 4 | 0.23 | 1.77 | 0.045 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C22H30O5 | H | 373.202021 | 5377315 | 5377315.00 | 373.202048 | -0.0713 | -1 | 8 | 0.23 | 1.36 | 0.000 | 0.000 | 0.18 | CHO |
| 2015-05-02 | 2015-05-05 | C13H23NO3 | H | 240.160522 | 6024505 | 6024505.00 | 240.160517 | 0.0202 | -1 | 3 | 0.23 | 1.77 | 0.077 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C17H30N2O4 | H | 325.213305 | 4694601 | 4694601.00 | 325.213281 | 0.0738 | -1 | 4 | 0.24 | 1.76 | 0.118 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C17H24O4S | H | 323.132259 | 6061085 | 6061085.00 | 323.132253 | 0.0170 | -1 | 6 | 0.24 | 1.41 | 0.000 | 0.059 | 0.08 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H26O4 | H | 293.175837 | 80478392 | 94323174.00 | 293.175833 | 0.0141 | -1 | 5 | 0.24 | 1.53 | 0.000 | 0.000 | 0.08 | CHO |
| 2015-05-02 | 2015-05-05 | C17H22O4 | H | 289.144535 | 5947451 | 5947451.00 | 289.144533 | 0.0078 | -1 | 7 | 0.24 | 1.29 | 0.000 | 0.000 | 0.23 | CHO |
| 2015-05-02 | 2015-05-05 | C17H29NO4S | H | 342.174453 | 15282961 | 15282961.00 | 342.174453 | 0.0010 | -1 | 4 | 0.24 | 1.71 | 0.059 | 0.059 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C17H23NO4 | H | 304.155432 | 5287152 | 5287152.00 | 304.155432 | 0.0007 | -1 | 7 | 0.24 | 1.35 | 0.059 | 0.000 | 0.21 | CHON |
| 2015-05-02 | 2015-05-05 | C17H34N2O4 | H | 329.244580 | 6159963 | 6159963.00 | 329.244581 | -0.0035 | -1 | 2 | 0.24 | 2.00 | 0.118 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C17H27NO4S | H | 340.158800 | 11316680 | 11316680.00 | 340.158803 | -0.0076 | -1 | 5 | 0.24 | 1.59 | 0.059 | 0.059 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C17H25NO4S | H | 338.143143 | 5437512 | 5437512.00 | 338.143153 | -0.0282 | -1 | 6 | 0.24 | 1.47 | 0.059 | 0.059 | 0.05 | CHONS |
| 2015-05-02 | 2015-05-05 | C17H30O4S | H | 329.179178 | 7773737 | 7773737.00 | 329.179204 | -0.0780 | -1 | 3 | 0.24 | 1.76 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H37NO5S | H | 414.231989 | 5625440 | 5625440.00 | 414.231968 | 0.0518 | -1 | 4 | 0.24 | 1.76 | 0.048 | 0.048 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C21H34O5 | H | 365.233361 | 10500258 | 10500258.00 | 365.233348 | 0.0363 | -1 | 5 | 0.24 | 1.62 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C21H33NO5 | H | 378.228608 | 5287645 | 5287645.00 | 378.228597 | 0.0298 | -1 | 6 | 0.24 | 1.57 | 0.048 | 0.000 | 0.03 | CHON |
| 2015-05-02 | 2015-05-05 | C21H28O5 | H | 359.186406 | 5698289 | 5698289.00 | 359.186398 | 0.0235 | -1 | 8 | 0.24 | 1.33 | 0.000 | 0.000 | 0.19 | CHO |
| 2015-05-02 | 2015-05-05 | C21H35NO5S | H | 412.216325 | 5895002 | 5895002.00 | 412.216317 | 0.0183 | -1 | 5 | 0.24 | 1.67 | 0.048 | 0.048 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C21H30O5 | H | 361.202052 | 9270555 | 9270555.00 | 361.202048 | 0.0121 | -1 | 7 | 0.24 | 1.43 | 0.000 | 0.000 | 0.13 | CHO |
| 2015-05-02 | 2015-05-05 | C21H32O5S | H | 395.189772 | 6243321 | 6243321.00 | 395.189768 | 0.0092 | -1 | 6 | 0.24 | 1.52 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H36O5 | H | 367.248993 | 10926603 | 10926603.00 | 367.248998 | -0.0131 | -1 | 4 | 0.24 | 1.71 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C21H34O5S | H | 397.205411 | 17556728 | 17556728.00 | 397.205418 | -0.0187 | -1 | 5 | 0.24 | 1.62 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H32O5 | H | 363.217690 | 9500414 | 9500414.00 | 363.217698 | -0.0212 | -1 | 6 | 0.24 | 1.52 | 0.000 | 0.000 | 0.06 | CHO |
| 2015-05-02 | 2015-05-05 | C21H37NO5 | H | 382.259878 | 7839728 | 7839728.00 | 382.259897 | -0.0493 | -1 | 4 | 0.24 | 1.76 | 0.048 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C21H38O5S | H | 401.236688 | 4863874 | 4863874.00 | 401.236719 | -0.0762 | -1 | 3 | 0.24 | 1.81 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H35NO5 | H | 380.244212 | 4579179 | 4579179.00 | 380.244247 | -0.0915 | -1 | 5 | 0.24 | 1.67 | 0.048 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C25H46O6 | H | 441.322187 | 5024795 | 5024795.00 | 441.322163 | 0.0549 | -1 | 3 | 0.24 | 1.84 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H30O5S | H | 381.174142 | 11288489 | 11288489.00 | 381.174118 | 0.0621 | -1 | 6 | 0.25 | 1.50 | 0.000 | 0.050 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C24H44O6 | H | 427.306528 | 6393463 | 6393463.00 | 427.306513 | 0.0358 | -1 | 3 | 0.25 | 1.83 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H35NO5 | H | 368.244260 | 9804458 | 9804458.00 | 368.244247 | 0.0359 | -1 | 4 | 0.25 | 1.75 | 0.050 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C24H38O6 | H | 421.259571 | 5407367 | 5407367.00 | 421.259563 | 0.0202 | -1 | 6 | 0.25 | 1.58 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H32O5 | H | 351.217703 | 12338997 | 12338997.00 | 351.217698 | 0.0151 | -1 | 5 | 0.25 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H35NO5S | H | 400.216322 | 9922250 | 9922250.00 | 400.216317 | 0.0113 | -1 | 4 | 0.25 | 1.75 | 0.050 | 0.050 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C20H30O5 | H | 349.202051 | 11977553 | 11977553.00 | 349.202048 | 0.0097 | -1 | 6 | 0.25 | 1.50 | 0.000 | 0.000 | 0.07 | CHO |
| 2015-05-02 | 2015-05-05 | C20H33NO5S | H | 398.200669 | 13370759 | 13370759.00 | 398.200667 | 0.0040 | -1 | 5 | 0.25 | 1.65 | 0.050 | 0.050 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C20H29NO5 | H | 362.197298 | 6776338 | 6776338.00 | 362.197297 | 0.0039 | -1 | 7 | 0.25 | 1.45 | 0.050 | 0.000 | 0.11 | CHON |
| 2015-05-02 | 2015-05-05 | C20H31NO5 | H | 364.212944 | 7411669 | 7411669.00 | 364.212947 | -0.0073 | -1 | 6 | 0.25 | 1.55 | 0.050 | 0.000 | 0.04 | CHON |
| 2015-05-02 | 2015-05-05 | C20H31NO5S | H | 396.185014 | 5489778 | 5489778.00 | 396.185017 | -0.0085 | -1 | 6 | 0.25 | 1.55 | 0.050 | 0.050 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C16H25NO4 | H | 294.171076 | 5140781 | 5140781.00 | 294.171082 | -0.0199 | -1 | 5 | 0.25 | 1.56 | 0.063 | 0.000 | 0.05 | CHON |
| 2015-05-02 | 2015-05-05 | C20H33NO5 | H | 366.228585 | 5499227 | 5499227.00 | 366.228597 | -0.0320 | -1 | 5 | 0.25 | 1.65 | 0.050 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H26O5 | H | 345.170732 | 5745268 | 5745268.00 | 345.170747 | -0.0449 | -1 | 8 | 0.25 | 1.30 | 0.000 | 0.000 | 0.20 | CHO |
| 2015-05-02 | 2015-05-05 | C20H27NO5 | H | 360.181630 | 5329932 | 5329932.00 | 360.181647 | -0.0459 | -1 | 8 | 0.25 | 1.35 | 0.050 | 0.000 | 0.18 | CHON |
| 2015-05-02 | 2015-05-05 | C16H23NO4 | H | 292.155414 | 4321386 | 4321386.00 | 292.155432 | -0.0609 | -1 | 6 | 0.25 | 1.44 | 0.063 | 0.000 | 0.14 | CHON |
| 2015-05-02 | 2015-05-05 | C20H34O5 | H | 353.233329 | 14764724 | 14764724.00 | 353.233348 | -0.0531 | -1 | 4 | 0.25 | 1.70 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C24H40O6 | H | 423.275193 | 4523619 | 4523619.00 | 423.275213 | -0.0462 | -1 | 5 | 0.25 | 1.67 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H24O5 | H | 343.155077 | 4507021 | 4507021.00 | 343.155097 | -0.0595 | -1 | 9 | 0.25 | 1.20 | 0.000 | 0.000 | 0.27 | CHO |
| 2015-05-02 | 2015-05-05 | C20H28O5 | H | 347.186377 | 14352142 | 14352142.00 | 347.186398 | -0.0592 | -1 | 7 | 0.25 | 1.40 | 0.000 | 0.000 | 0.13 | CHO |
| 2015-05-02 | 2015-05-05 | C24H42O6 | H | 425.290834 | 4545119 | 4545119.00 | 425.290863 | -0.0673 | -1 | 4 | 0.25 | 1.75 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C24H34O6 | H | 417.228232 | 5671751 | 5671751.00 | 417.228262 | -0.0728 | -1 | 8 | 0.25 | 1.42 | 0.000 | 0.000 | 0.11 | CHO |
| 2015-05-02 | 2015-05-05 | C23H42O6 | H | 413.290899 | 5985519 | 5985519.00 | 413.290863 | 0.0880 | -1 | 3 | 0.26 | 1.83 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H36O6 | H | 407.243947 | 5618939 | 5618939.00 | 407.243912 | 0.0849 | -1 | 6 | 0.26 | 1.57 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H43NO6 | H | 428.301770 | 5361797 | 5361797.00 | 428.301762 | 0.0195 | -1 | 3 | 0.26 | 1.87 | 0.043 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C23H38O6 | H | 409.259548 | 5594973 | 5594973.00 | 409.259563 | -0.0354 | -1 | 5 | 0.26 | 1.65 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H40O6 | H | 411.275184 | 6386182 | 6386182.00 | 411.275213 | -0.0695 | -1 | 4 | 0.26 | 1.74 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H35NO5S | H | 388.216333 | 4891001 | 4891001.00 | 388.216317 | 0.0400 | -1 | 3 | 0.26 | 1.84 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H39NO5 | H | 360.275553 | 10269734 | 10269734.00 | 360.275547 | 0.0169 | -1 | 1 | 0.26 | 2.05 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H31NO5 | H | 352.212950 | 6678779 | 6678779.00 | 352.212947 | 0.0095 | -1 | 5 | 0.26 | 1.63 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H32O5 | H | 339.217701 | 21048124 | 21048124.00 | 339.217698 | 0.0098 | -1 | 4 | 0.26 | 1.68 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H28O5S | H | 367.158471 | 14178812 | 14178812.00 | 367.158468 | 0.0075 | -1 | 6 | 0.26 | 1.47 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H31NO5S | H | 384.185018 | 15343722 | 15343722.00 | 384.185017 | 0.0017 | -1 | 5 | 0.26 | 1.63 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H24O5 | H | 331.155096 | 5698576 | 5698576.00 | 331.155097 | -0.0043 | -1 | 8 | 0.26 | 1.26 | 0.000 | 0.000 | 0.21 | CHO |
| 2015-05-02 | 2015-05-05 | C19H26O5 | H | 333.170745 | 11057671 | 11057671.00 | 333.170747 | -0.0075 | -1 | 7 | 0.26 | 1.37 | 0.000 | 0.000 | 0.14 | CHO |
| 2015-05-02 | 2015-05-05 | C19H27NO5 | H | 348.181643 | 7827764 | 7827764.00 | 348.181647 | -0.0101 | -1 | 7 | 0.26 | 1.42 | 0.053 | 0.000 | 0.12 | CHON |
| 2015-05-02 | 2015-05-05 | C19H28O5 | H | 335.186392 | 13680615 | 13680615.00 | 335.186398 | -0.0166 | -1 | 6 | 0.26 | 1.47 | 0.000 | 0.000 | 0.07 | CHO |
| 2015-05-02 | 2015-05-05 | C19H25NO5 | H | 346.165990 | 5598404 | 5598404.00 | 346.165996 | -0.0187 | -1 | 8 | 0.26 | 1.32 | 0.053 | 0.000 | 0.19 | CHON |
| 2015-05-02 | 2015-05-05 | C19H30O5 | H | 337.202038 | 17163686 | 17163686.00 | 337.202048 | -0.0285 | -1 | 5 | 0.26 | 1.58 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H29NO5 | H | 350.197285 | 8668489 | 8668489.00 | 350.197297 | -0.0331 | -1 | 6 | 0.26 | 1.53 | 0.053 | 0.000 | 0.04 | CHON |
| 2015-05-02 | 2015-05-05 | C19H33NO5S | H | 386.200653 | 14311661 | 14311661.00 | 386.200667 | -0.0373 | -1 | 4 | 0.26 | 1.74 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H29NO5S | H | 382.169345 | 8945642 | 8945642.00 | 382.169367 | -0.0583 | -1 | 6 | 0.26 | 1.53 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H33NO5 | H | 354.228568 | 7470155 | 7470155.00 | 354.228597 | -0.0811 | -1 | 4 | 0.26 | 1.74 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C15H25NO4 | H | 282.171106 | 4297534 | 4297534.00 | 282.171082 | 0.0856 | -1 | 4 | 0.27 | 1.67 | 0.067 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C15H26O4 | H | 269.175842 | 12803748 | 12803748.00 | 269.175833 | 0.0339 | -1 | 3 | 0.27 | 1.73 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H22O4S | H | 297.116612 | 8520530 | 8520530.00 | 297.116603 | 0.0288 | -1 | 5 | 0.27 | 1.47 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H23NO4 | H | 280.155432 | 4799680 | 4799680.00 | 280.155432 | 0.0008 | -1 | 5 | 0.27 | 1.53 | 0.067 | 0.000 | 0.05 | CHON |
| 2015-05-02 | 2015-05-05 | C15H22O4 | H | 265.144532 | 8479175 | 8479175.00 | 265.144533 | -0.0028 | -1 | 5 | 0.27 | 1.47 | 0.000 | 0.000 | 0.09 | CHO |
| 2015-05-02 | 2015-05-05 | C15H20O4 | H | 263.128879 | 4393728 | 4393728.00 | 263.128883 | -0.0140 | -1 | 6 | 0.27 | 1.33 | 0.000 | 0.000 | 0.18 | CHO |
| 2015-05-02 | 2015-05-05 | C22H39NO6S | H | 444.242564 | 4604451 | 4604451.00 | 444.242532 | 0.0715 | -1 | 4 | 0.27 | 1.77 | 0.045 | 0.045 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C22H43NO6S | H | 448.273857 | 6052385 | 6052385.00 | 448.273832 | 0.0550 | -1 | 2 | 0.27 | 1.95 | 0.045 | 0.045 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C22H36O6S | H | 427.215994 | 5852743 | 5852743.00 | 427.215983 | 0.0255 | -1 | 5 | 0.27 | 1.64 | 0.000 | 0.045 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C22H38O6S | H | 429.231640 | 8925812 | 8925812.00 | 429.231633 | 0.0159 | -1 | 4 | 0.27 | 1.73 | 0.000 | 0.045 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C22H45NO6S | H | 450.289486 | 14548462 | 14548462.00 | 450.289482 | 0.0080 | -1 | 1 | 0.27 | 2.05 | 0.045 | 0.045 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C22H32O6 | H | 391.212615 | 6107750 | 6107750.00 | 391.212612 | 0.0069 | -1 | 7 | 0.27 | 1.45 | 0.000 | 0.000 | 0.06 | CHO |
| 2015-05-02 | 2015-05-05 | C22H36O6 | H | 395.243913 | 6267903 | 6267903.00 | 395.243912 | 0.0014 | -1 | 5 | 0.27 | 1.64 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H38O6 | H | 397.259562 | 9323776 | 9323776.00 | 397.259563 | -0.0013 | -1 | 4 | 0.27 | 1.73 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C11H20O3 | H | 199.133967 | 5639902 | 5639902.00 | 199.133968 | -0.0053 | -1 | 2 | 0.27 | 1.82 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H40O6 | H | 399.275210 | 10749485 | 10749485.00 | 399.275213 | -0.0064 | -1 | 3 | 0.27 | 1.82 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H41NO6 | H | 414.286106 | 5006966 | 5006966.00 | 414.286112 | -0.0135 | -1 | 3 | 0.27 | 1.86 | 0.045 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C22H40O6S | H | 431.247261 | 4921009 | 4921009.00 | 431.247283 | -0.0516 | -1 | 3 | 0.27 | 1.82 | 0.000 | 0.045 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C22H42O6 | H | 401.290833 | 5400460 | 5400460.00 | 401.290863 | -0.0738 | -1 | 2 | 0.27 | 1.91 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H34O5S | H | 361.205436 | 4543772 | 4543772.00 | 361.205418 | 0.0486 | -1 | 2 | 0.28 | 1.89 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H23NO5 | H | 332.150359 | 12203780 | 12203780.00 | 332.150346 | 0.0379 | -1 | 8 | 0.28 | 1.28 | 0.056 | 0.000 | 0.21 | CHON |
| 2015-05-02 | 2015-05-05 | C18H32O5S | H | 359.189779 | 19862258 | 19862258.00 | 359.189768 | 0.0296 | -1 | 3 | 0.28 | 1.78 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H25NO5 | H | 334.166001 | 6212849 | 6212849.00 | 334.165996 | 0.0136 | -1 | 7 | 0.28 | 1.39 | 0.056 | 0.000 | 0.13 | CHON |
| 2015-05-02 | 2015-05-05 | C18H33NO5 | H | 342.228599 | 15233845 | 15233845.00 | 342.228597 | 0.0067 | -1 | 3 | 0.28 | 1.83 | 0.056 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H28O5S | H | 355.158470 | 31362482 | 37457106.00 | 355.158468 | 0.0049 | -1 | 5 | 0.28 | 1.56 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H27NO5S | H | 368.153718 | 4442781 | 4442781.00 | 368.153717 | 0.0021 | -1 | 6 | 0.28 | 1.50 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H33NO5S | H | 374.200668 | 6569352 | 6569352.00 | 374.200667 | 0.0016 | -1 | 3 | 0.28 | 1.83 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H31NO5S | H | 372.185010 | 10476725 | 10476725.00 | 372.185017 | -0.0197 | -1 | 4 | 0.28 | 1.72 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H29NO5S | H | 370.169358 | 8600510 | 8600510.00 | 370.169367 | -0.0251 | -1 | 5 | 0.28 | 1.61 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H27NO5 | H | 336.181629 | 7103170 | 7103170.00 | 336.181647 | -0.0521 | -1 | 6 | 0.28 | 1.50 | 0.056 | 0.000 | 0.04 | CHON |
| 2015-05-02 | 2015-05-05 | C18H26O5S | H | 353.142799 | 8833678 | 8833678.00 | 353.142818 | -0.0543 | -1 | 6 | 0.28 | 1.44 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H24O5 | H | 319.155076 | 6733980 | 6733980.00 | 319.155097 | -0.0671 | -1 | 7 | 0.28 | 1.33 | 0.000 | 0.000 | 0.15 | CHO |
| 2015-05-02 | 2015-05-05 | C21H32O6S | H | 411.184768 | 4620774 | 4620774.00 | 411.184683 | 0.2067 | -1 | 6 | 0.29 | 1.52 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H31NO6 | H | 392.207938 | 4459200 | 4459200.00 | 392.207861 | 0.1956 | -1 | 7 | 0.29 | 1.48 | 0.048 | 0.000 | 0.04 | CHON |
| 2015-05-02 | 2015-05-05 | C21H35NO6S | H | 428.211276 | 5345365 | 5345365.00 | 428.211232 | 0.1025 | -1 | 5 | 0.29 | 1.67 | 0.048 | 0.048 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C21H39NO6 | H | 400.270481 | 5453524 | 5453524.00 | 400.270462 | 0.0486 | -1 | 3 | 0.29 | 1.86 | 0.048 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C21H38O6S | H | 417.231645 | 7428937 | 7428937.00 | 417.231633 | 0.0283 | -1 | 3 | 0.29 | 1.81 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H36O6S | H | 415.215993 | 12105711 | 12105711.00 | 415.215983 | 0.0238 | -1 | 4 | 0.29 | 1.71 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H36O6 | H | 383.243921 | 9936942 | 9936942.00 | 383.243912 | 0.0223 | -1 | 4 | 0.29 | 1.71 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H20O4 | H | 251.128888 | 5257723 | 5257723.00 | 251.128883 | 0.0212 | -1 | 5 | 0.29 | 1.43 | 0.000 | 0.000 | 0.10 | CHO |
| 2015-05-02 | 2015-05-05 | C14H26O4 | H | 257.175836 | 30020764 | 34566514.11 | 257.175833 | 0.0122 | -1 | 2 | 0.29 | 1.86 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C21H37NO6 | H | 398.254814 | 6219151 | 6219151.00 | 398.254811 | 0.0063 | -1 | 4 | 0.29 | 1.76 | 0.048 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C21H37NO6S | H | 430.226884 | 5592202 | 5592202.00 | 430.226882 | 0.0043 | -1 | 4 | 0.29 | 1.76 | 0.048 | 0.048 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C14H23NO4 | H | 268.155433 | 4847489 | 4847489.00 | 268.155432 | 0.0046 | -1 | 4 | 0.29 | 1.64 | 0.071 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C21H30O6 | H | 377.196962 | 7388814 | 7388814.00 | 377.196962 | -0.0006 | -1 | 7 | 0.29 | 1.43 | 0.000 | 0.000 | 0.07 | CHO |
| 2015-05-02 | 2015-05-05 | C14H20O4S | H | 283.100950 | 4412064 | 4412064.00 | 283.100953 | -0.0119 | -1 | 5 | 0.29 | 1.43 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H34O6 | H | 381.228257 | 7782317 | 7782317.00 | 381.228262 | -0.0141 | -1 | 5 | 0.29 | 1.62 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C21H34O6S | H | 413.200324 | 11048140 | 11048140.00 | 413.200333 | -0.0219 | -1 | 5 | 0.29 | 1.62 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H32O6 | H | 379.212603 | 7544612 | 7544612.00 | 379.212612 | -0.0245 | -1 | 6 | 0.29 | 1.52 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C21H38O6 | H | 385.259551 | 14508207 | 17803460.42 | 385.259563 | -0.0299 | -1 | 3 | 0.29 | 1.81 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H27N3O4S | H | 332.164932 | 6631183 | 6631183.00 | 332.164951 | -0.0560 | -1 | 3 | 0.29 | 1.93 | 0.214 | 0.071 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C24H40O7 | H | 439.270159 | 5543881 | 5543881.00 | 439.270127 | 0.0724 | -1 | 5 | 0.29 | 1.67 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C24H42O7 | H | 441.285780 | 4615176 | 4615176.00 | 441.285777 | 0.0062 | -1 | 4 | 0.29 | 1.75 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H23NO5 | H | 320.150384 | 4940657 | 4940657.00 | 320.150346 | 0.1174 | -1 | 7 | 0.29 | 1.35 | 0.059 | 0.000 | 0.14 | CHON |
| 2015-05-02 | 2015-05-05 | C17H35NO5 | H | 332.244275 | 4790091 | 4790091.00 | 332.244247 | 0.0849 | -1 | 1 | 0.29 | 2.06 | 0.059 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C17H25NO5 | H | 322.166014 | 5175623 | 5175623.00 | 322.165996 | 0.0544 | -1 | 6 | 0.29 | 1.47 | 0.059 | 0.000 | 0.05 | CHON |
| 2015-05-02 | 2015-05-05 | C17H29NO5S | H | 358.169383 | 5493181 | 5493181.00 | 358.169367 | 0.0439 | -1 | 4 | 0.29 | 1.71 | 0.059 | 0.059 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C17H24O5S | H | 339.127177 | 5044990 | 5044990.00 | 339.127168 | 0.0262 | -1 | 6 | 0.29 | 1.41 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H27NO5S | H | 356.153726 | 5824285 | 5824285.00 | 356.153717 | 0.0247 | -1 | 5 | 0.29 | 1.59 | 0.059 | 0.059 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C17H28O5S | H | 343.158473 | 27456912 | 32505342.65 | 343.158468 | 0.0139 | -1 | 4 | 0.29 | 1.65 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H26O5S | H | 341.142821 | 18067556 | 18067556.00 | 341.142818 | 0.0083 | -1 | 5 | 0.29 | 1.53 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H24O5 | H | 307.155089 | 7520942 | 7520942.00 | 307.155097 | -0.0274 | -1 | 6 | 0.29 | 1.41 | 0.000 | 0.000 | 0.08 | CHO |
| 2015-05-02 | 2015-05-05 | C17H30O5S | H | 345.174109 | 9558646 | 9558646.00 | 345.174118 | -0.0270 | -1 | 3 | 0.29 | 1.76 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C20H35NO6S | H | 416.211261 | 6732176 | 6732176.00 | 416.211232 | 0.0694 | -1 | 4 | 0.30 | 1.75 | 0.050 | 0.050 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C20H37NO6 | H | 386.254833 | 6181105 | 6181105.00 | 386.254811 | 0.0557 | -1 | 3 | 0.30 | 1.85 | 0.050 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H33NO6 | H | 382.223532 | 5586925 | 5586925.00 | 382.223511 | 0.0540 | -1 | 5 | 0.30 | 1.65 | 0.050 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H34O6 | H | 369.228282 | 12311356 | 12311356.00 | 369.228262 | 0.0532 | -1 | 4 | 0.30 | 1.70 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H26O6 | H | 361.165672 | 5911826 | 5911826.00 | 361.165662 | 0.0274 | -1 | 8 | 0.30 | 1.30 | 0.000 | 0.000 | 0.14 | CHO |
| 2015-05-02 | 2015-05-05 | C20H35NO6 | H | 384.239170 | 5054574 | 5054574.00 | 384.239161 | 0.0224 | -1 | 4 | 0.30 | 1.75 | 0.050 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H36O6S | H | 403.215991 | 14018832 | 14018832.00 | 403.215983 | 0.0195 | -1 | 3 | 0.30 | 1.80 | 0.000 | 0.050 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C20H29NO6 | H | 378.192216 | 5291738 | 5291738.00 | 378.192211 | 0.0126 | -1 | 7 | 0.30 | 1.45 | 0.050 | 0.000 | 0.04 | CHON |
| 2015-05-02 | 2015-05-05 | C20H32O6 | H | 367.212617 | 12630533 | 12630533.00 | 367.212612 | 0.0128 | -1 | 5 | 0.30 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H39NO6 | H | 388.270464 | 5685629 | 5685629.00 | 388.270462 | 0.0063 | -1 | 2 | 0.30 | 1.95 | 0.050 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H28O6 | H | 363.181311 | 10827510 | 10827510.00 | 363.181312 | -0.0032 | -1 | 7 | 0.30 | 1.40 | 0.000 | 0.000 | 0.07 | CHO |
| 2015-05-02 | 2015-05-05 | C20H32O6S | H | 399.184681 | 16197150 | 16197150.00 | 399.184683 | -0.0050 | -1 | 5 | 0.30 | 1.60 | 0.000 | 0.050 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C20H30O6 | H | 365.196958 | 12261531 | 12261531.00 | 365.196962 | -0.0116 | -1 | 6 | 0.30 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H30O6S | H | 397.169026 | 4781300 | 4781300.00 | 397.169033 | -0.0175 | -1 | 6 | 0.30 | 1.50 | 0.000 | 0.050 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C20H37NO6S | H | 418.226875 | 4648194 | 4648194.00 | 418.226882 | -0.0171 | -1 | 3 | 0.30 | 1.85 | 0.050 | 0.050 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C10H16O3 | H | 183.102656 | 3777303 | 3777303.00 | 183.102668 | -0.0651 | -1 | 3 | 0.30 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H31NO6 | H | 380.207848 | 4869993 | 4869993.00 | 380.207861 | -0.0349 | -1 | 6 | 0.30 | 1.55 | 0.050 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H34O6S | H | 401.200318 | 20801402 | 20801402.00 | 401.200333 | -0.0375 | -1 | 4 | 0.30 | 1.70 | 0.000 | 0.050 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C20H33NO6S | H | 414.195564 | 6895186 | 6895186.00 | 414.195582 | -0.0435 | -1 | 5 | 0.30 | 1.65 | 0.050 | 0.050 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C23H38O7 | H | 425.254510 | 5036621 | 5036621.00 | 425.254477 | 0.0773 | -1 | 5 | 0.30 | 1.65 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H40O7 | H | 427.270160 | 5508708 | 5508708.00 | 427.270127 | 0.0768 | -1 | 4 | 0.30 | 1.74 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H42O7 | H | 429.285806 | 5051025 | 5051025.00 | 429.285777 | 0.0670 | -1 | 3 | 0.30 | 1.83 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H34O7 | H | 421.223165 | 5018229 | 5018229.00 | 421.223177 | -0.0285 | -1 | 7 | 0.30 | 1.48 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C23H32O7 | H | 419.207505 | 4792000 | 4792000.00 | 419.207527 | -0.0523 | -1 | 8 | 0.30 | 1.39 | 0.000 | 0.000 | 0.06 | CHO |
| 2015-05-02 | 2015-05-05 | C13H20O4S | H | 271.100952 | 4550894 | 4550894.00 | 271.100953 | -0.0050 | -1 | 4 | 0.31 | 1.54 | 0.000 | 0.077 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H29NO5 | H | 314.197307 | 5268262 | 5268262.00 | 314.197297 | 0.0331 | -1 | 3 | 0.31 | 1.81 | 0.063 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C16H26O5S | H | 329.142818 | 9317901 | 9317901.00 | 329.142818 | -0.0006 | -1 | 4 | 0.31 | 1.63 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H33NO5S | H | 350.200658 | 8267083 | 8267083.00 | 350.200667 | -0.0269 | -1 | 1 | 0.31 | 2.06 | 0.063 | 0.063 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C16H24O5S | H | 327.127154 | 6400002 | 6400002.00 | 327.127168 | -0.0432 | -1 | 5 | 0.31 | 1.50 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H22O5 | H | 293.139432 | 6418616 | 6418616.00 | 293.139447 | -0.0524 | -1 | 6 | 0.31 | 1.38 | 0.000 | 0.000 | 0.09 | CHO |
| 2015-05-02 | 2015-05-05 | C16H28O5S | H | 331.158452 | 4658194 | 4658194.00 | 331.158468 | -0.0491 | -1 | 3 | 0.31 | 1.75 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H32O5S | H | 335.189745 | 4972522 | 4972522.00 | 335.189768 | -0.0697 | -1 | 1 | 0.31 | 2.00 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H27NO5 | H | 312.181616 | 4496912 | 4496912.00 | 312.181647 | -0.0978 | -1 | 4 | 0.31 | 1.69 | 0.063 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H31NO6S | H | 400.179955 | 4859588 | 4859588.00 | 400.179932 | 0.0575 | -1 | 5 | 0.32 | 1.63 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H24O6 | H | 347.150032 | 5320441 | 5320441.00 | 347.150012 | 0.0575 | -1 | 8 | 0.32 | 1.26 | 0.000 | 0.000 | 0.15 | CHO |
| 2015-05-02 | 2015-05-05 | C19H29NO6 | H | 366.192227 | 7412053 | 7412053.00 | 366.192211 | 0.0431 | -1 | 6 | 0.32 | 1.53 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H28O6S | H | 383.153392 | 5861417 | 5861417.00 | 383.153383 | 0.0238 | -1 | 6 | 0.32 | 1.47 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H30O6S | H | 385.169042 | 15655082 | 15655082.00 | 385.169033 | 0.0235 | -1 | 5 | 0.32 | 1.58 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H27NO6 | H | 364.176570 | 12064717 | 12064717.00 | 364.176561 | 0.0243 | -1 | 7 | 0.32 | 1.42 | 0.053 | 0.000 | 0.04 | CHON |
| 2015-05-02 | 2015-05-05 | C19H26O6 | H | 349.165669 | 9700158 | 9700158.00 | 349.165662 | 0.0197 | -1 | 7 | 0.32 | 1.37 | 0.000 | 0.000 | 0.08 | CHO |
| 2015-05-02 | 2015-05-05 | C19H35NO6 | H | 372.239168 | 6651067 | 6651067.00 | 372.239161 | 0.0177 | -1 | 3 | 0.32 | 1.84 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H32O6S | H | 387.184689 | 22864176 | 27562737.73 | 387.184683 | 0.0155 | -1 | 4 | 0.32 | 1.68 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H36O6 | H | 359.243916 | 18666242 | 22502133.15 | 359.243912 | 0.0099 | -1 | 2 | 0.32 | 1.89 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H33NO6 | H | 370.223514 | 6732741 | 6732741.00 | 370.223511 | 0.0072 | -1 | 4 | 0.32 | 1.74 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H33NO6S | H | 402.195583 | 5892156 | 5892156.00 | 402.195582 | 0.0024 | -1 | 4 | 0.32 | 1.74 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H38O6 | H | 361.259562 | 14030122 | 14030122.00 | 361.259563 | -0.0014 | -1 | 1 | 0.32 | 2.00 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H32O6 | H | 355.212611 | 12209606 | 12209606.00 | 355.212612 | -0.0037 | -1 | 4 | 0.32 | 1.68 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H28O6 | H | 351.181305 | 13215524 | 13215524.00 | 351.181312 | -0.0204 | -1 | 6 | 0.32 | 1.47 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H31NO6 | H | 368.207854 | 4606629 | 4606629.00 | 368.207861 | -0.0198 | -1 | 5 | 0.32 | 1.63 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H34O6 | H | 357.228250 | 16830606 | 16830606.00 | 357.228262 | -0.0346 | -1 | 3 | 0.32 | 1.79 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H39NO6 | H | 376.270449 | 4542019 | 4542019.00 | 376.270462 | -0.0333 | -1 | 1 | 0.32 | 2.05 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H34O6S | H | 389.200313 | 16277954 | 16277954.00 | 389.200333 | -0.0515 | -1 | 3 | 0.32 | 1.79 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H30O6 | H | 353.196942 | 14060197 | 14060197.00 | 353.196962 | -0.0573 | -1 | 5 | 0.32 | 1.58 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H38O7S | H | 445.226595 | 5252129 | 5252129.00 | 445.226548 | 0.1060 | -1 | 4 | 0.32 | 1.73 | 0.000 | 0.045 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C22H36O7 | H | 411.238847 | 5353977 | 5353977.00 | 411.238827 | 0.0485 | -1 | 5 | 0.32 | 1.64 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H34O7 | H | 409.223189 | 5795666 | 5795666.00 | 409.223177 | 0.0293 | -1 | 6 | 0.32 | 1.55 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H40O7 | H | 415.270135 | 7583750 | 7583750.00 | 415.270127 | 0.0188 | -1 | 3 | 0.32 | 1.82 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H38O7 | H | 413.254483 | 5493985 | 5493985.00 | 413.254477 | 0.0142 | -1 | 4 | 0.32 | 1.73 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H30O7 | H | 405.191856 | 4598490 | 4598490.00 | 405.191877 | -0.0515 | -1 | 8 | 0.32 | 1.36 | 0.000 | 0.000 | 0.07 | CHO |
| 2015-05-02 | 2015-05-05 | C25H40O8 | H | 467.265076 | 5485988 | 5485988.00 | 467.265042 | 0.0732 | -1 | 6 | 0.32 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C21H34O7S | H | 429.195292 | 4928096 | 4928096.00 | 429.195248 | 0.1033 | -1 | 5 | 0.33 | 1.62 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H36O7 | H | 399.238848 | 7480871 | 7480871.00 | 399.238827 | 0.0525 | -1 | 4 | 0.33 | 1.71 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H26O5S | H | 317.142834 | 4774656 | 4774656.00 | 317.142818 | 0.0499 | -1 | 3 | 0.33 | 1.73 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H35NO6 | H | 360.239176 | 4727836 | 4727836.00 | 360.239161 | 0.0405 | -1 | 2 | 0.33 | 1.94 | 0.056 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H27NO6 | H | 352.176572 | 5404907 | 5404907.00 | 352.176561 | 0.0308 | -1 | 6 | 0.33 | 1.50 | 0.056 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H24O6 | H | 335.150022 | 7266252 | 7266252.00 | 335.150012 | 0.0297 | -1 | 7 | 0.33 | 1.33 | 0.000 | 0.000 | 0.08 | CHO |
| 2015-05-02 | 2015-05-05 | C18H37NO6S | H | 394.226891 | 4711308 | 4711308.00 | 394.226882 | 0.0224 | -1 | 1 | 0.33 | 2.06 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H30O6 | H | 341.196971 | 21000328 | 21000328.00 | 341.196962 | 0.0257 | -1 | 4 | 0.33 | 1.67 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H33NO6 | H | 358.223520 | 6787534 | 6787534.00 | 358.223511 | 0.0242 | -1 | 3 | 0.33 | 1.83 | 0.056 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C12H20O4 | H | 227.128891 | 6814301 | 6814301.00 | 227.128883 | 0.0366 | -1 | 3 | 0.33 | 1.67 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H30O6S | H | 373.169038 | 11271456 | 11271456.00 | 373.169033 | 0.0136 | -1 | 4 | 0.33 | 1.67 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H34O7 | H | 397.223181 | 7841019 | 7841019.00 | 397.223177 | 0.0101 | -1 | 5 | 0.33 | 1.62 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H36O6S | H | 379.215987 | 6917924 | 6917924.00 | 379.215983 | 0.0102 | -1 | 1 | 0.33 | 2.00 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H17NO6 | H | 342.098314 | 14013151 | 14013151.00 | 342.098311 | 0.0093 | -1 | 11 | 0.33 | 0.94 | 0.056 | 0.000 | 0.41 | CHON |
| 2015-05-02 | 2015-05-05 | C18H22O6 | H | 333.134364 | 5540332 | 5540332.00 | 333.134362 | 0.0060 | -1 | 8 | 0.33 | 1.22 | 0.000 | 0.000 | 0.17 | CHO |
| 2015-05-02 | 2015-05-05 | C21H36O7S | H | 431.210899 | 10057373 | 10057373.00 | 431.210898 | 0.0029 | -1 | 4 | 0.33 | 1.71 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H28O6S | H | 371.153384 | 8739899 | 8739899.00 | 371.153383 | 0.0030 | -1 | 5 | 0.33 | 1.56 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H38O7S | H | 433.226547 | 7412454 | 7412454.00 | 433.226548 | -0.0019 | -1 | 3 | 0.33 | 1.81 | 0.000 | 0.048 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H36O6 | H | 347.243911 | 8830766 | 8830766.00 | 347.243912 | -0.0041 | -1 | 1 | 0.33 | 2.00 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C21H30O7 | H | 393.191869 | 5169952 | 5169952.00 | 393.191877 | -0.0200 | -1 | 7 | 0.33 | 1.43 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H31NO6 | H | 356.207853 | 6344496 | 6344496.00 | 356.207861 | -0.0232 | -1 | 4 | 0.33 | 1.72 | 0.056 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H31NO6S | H | 388.179923 | 11944310 | 11944310.00 | 388.179932 | -0.0231 | -1 | 4 | 0.33 | 1.72 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C15H24O5S | H | 315.127159 | 5916051 | 5916051.00 | 315.127168 | -0.0289 | -1 | 4 | 0.33 | 1.60 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H38O7 | H | 401.254467 | 6072197 | 6072197.00 | 401.254477 | -0.0252 | -1 | 3 | 0.33 | 1.81 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H25NO6 | H | 350.160900 | 4601143 | 4601143.00 | 350.160911 | -0.0317 | -1 | 7 | 0.33 | 1.39 | 0.056 | 0.000 | 0.05 | CHON |
| 2015-05-02 | 2015-05-05 | C18H26O6 | H | 337.165649 | 10552716 | 10552716.00 | 337.165662 | -0.0389 | -1 | 6 | 0.33 | 1.44 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H32O6S | H | 375.184666 | 8412644 | 8412644.00 | 375.184683 | -0.0453 | -1 | 3 | 0.33 | 1.78 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H32O7 | H | 395.207508 | 5575675 | 5575675.00 | 395.207527 | -0.0479 | -1 | 6 | 0.33 | 1.52 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H29NO6 | H | 354.192183 | 4750396 | 4750396.00 | 354.192211 | -0.0797 | -1 | 5 | 0.33 | 1.61 | 0.056 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H30O7 | H | 381.191910 | 7987115 | 7987115.00 | 381.191877 | 0.0869 | -1 | 6 | 0.35 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H34O7S | H | 417.195270 | 7445305 | 7445305.00 | 417.195248 | 0.0535 | -1 | 4 | 0.35 | 1.70 | 0.000 | 0.050 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C20H32O7S | H | 415.179599 | 4925408 | 4925408.00 | 415.179598 | 0.0033 | -1 | 5 | 0.35 | 1.60 | 0.000 | 0.050 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C20H32O7 | H | 383.207528 | 9592876 | 9592876.00 | 383.207527 | 0.0028 | -1 | 5 | 0.35 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H34O7 | H | 385.223176 | 7278765 | 7278765.00 | 385.223177 | -0.0026 | -1 | 4 | 0.35 | 1.70 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H36O7 | H | 387.238825 | 9601332 | 9601332.00 | 387.238827 | -0.0053 | -1 | 3 | 0.35 | 1.80 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H28O7 | H | 379.176210 | 5644066 | 5644066.00 | 379.176227 | -0.0443 | -1 | 7 | 0.35 | 1.40 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H38O7 | H | 389.254451 | 4587974 | 4587974.00 | 389.254477 | -0.0671 | -1 | 2 | 0.35 | 1.90 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H36O7S | H | 419.210867 | 6258370 | 6258370.00 | 419.210898 | -0.0733 | -1 | 3 | 0.35 | 1.80 | 0.000 | 0.050 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H35NO6S | H | 380.211255 | 9142121 | 9142121.00 | 380.211232 | 0.0602 | -1 | 1 | 0.35 | 2.06 | 0.059 | 0.059 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C17H28O6 | H | 327.181323 | 12871724 | 12871724.00 | 327.181312 | 0.0331 | -1 | 4 | 0.35 | 1.65 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H28O6S | H | 359.153389 | 8196840 | 8196840.00 | 359.153383 | 0.0171 | -1 | 4 | 0.35 | 1.65 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H22O6 | H | 321.134368 | 6432327 | 6432327.00 | 321.134362 | 0.0187 | -1 | 7 | 0.35 | 1.29 | 0.000 | 0.000 | 0.09 | CHO |
| 2015-05-02 | 2015-05-05 | C17H34O6S | H | 365.200337 | 12179611 | 12179611.00 | 365.200333 | 0.0108 | -1 | 1 | 0.35 | 2.00 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H24O6 | H | 323.150013 | 6675499 | 6675499.00 | 323.150012 | 0.0029 | -1 | 6 | 0.35 | 1.41 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H29NO6 | H | 342.192211 | 5468957 | 5468957.00 | 342.192211 | -0.0006 | -1 | 4 | 0.35 | 1.71 | 0.059 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C17H32O6 | H | 331.212611 | 6669372 | 6669372.00 | 331.212612 | -0.0039 | -1 | 2 | 0.35 | 1.88 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H27NO6 | H | 340.176557 | 5963221 | 5963221.00 | 340.176561 | -0.0122 | -1 | 5 | 0.35 | 1.59 | 0.059 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C17H30O6 | H | 329.196956 | 15552054 | 15552054.00 | 329.196962 | -0.0190 | -1 | 3 | 0.35 | 1.76 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H30O6S | H | 361.169026 | 6305043 | 6305043.00 | 361.169033 | -0.0192 | -1 | 3 | 0.35 | 1.76 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H26O6S | H | 357.137711 | 5558384 | 5558384.00 | 357.137733 | -0.0611 | -1 | 5 | 0.35 | 1.53 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H25NO6 | H | 338.160883 | 6101077 | 6101077.00 | 338.160911 | -0.0831 | -1 | 6 | 0.35 | 1.47 | 0.059 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C14H22O5S | H | 301.111531 | 5056528 | 5056528.00 | 301.111518 | 0.0430 | -1 | 4 | 0.36 | 1.57 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C14H20O5 | H | 267.123806 | 4632661 | 4632661.00 | 267.123797 | 0.0326 | -1 | 5 | 0.36 | 1.43 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H26O5S | H | 305.142823 | 4497083 | 4497083.00 | 305.142818 | 0.0158 | -1 | 2 | 0.36 | 1.86 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C14H28O5S | H | 307.158473 | 4854448 | 4854448.00 | 307.158468 | 0.0155 | -1 | 1 | 0.36 | 2.00 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C14H24O5 | H | 271.155094 | 7843041 | 7843041.00 | 271.155097 | -0.0126 | -1 | 3 | 0.36 | 1.71 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C11H16O4 | H | 211.097596 | 4503166 | 4503166.00 | 211.097583 | 0.0637 | -1 | 4 | 0.36 | 1.45 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C22H34O8 | H | 425.218075 | 5130810 | 5130810.00 | 425.218092 | -0.0391 | -1 | 6 | 0.36 | 1.55 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H34O7S | H | 405.195302 | 5970651 | 5970651.00 | 405.195248 | 0.1340 | -1 | 3 | 0.37 | 1.79 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H36O7S | H | 407.210939 | 4893938 | 4893938.00 | 407.210898 | 0.1013 | -1 | 2 | 0.37 | 1.89 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H30O7S | H | 401.163967 | 4790132 | 4790132.00 | 401.163948 | 0.0485 | -1 | 5 | 0.37 | 1.58 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H38O7S | H | 409.226565 | 4689747 | 4689747.00 | 409.226548 | 0.0420 | -1 | 1 | 0.37 | 2.00 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H30O7 | H | 369.191892 | 10246967 | 10246967.00 | 369.191877 | 0.0410 | -1 | 5 | 0.37 | 1.58 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H37NO7S | H | 422.221811 | 8307802 | 8307802.00 | 422.221797 | 0.0337 | -1 | 2 | 0.37 | 1.95 | 0.053 | 0.053 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C19H37NO7 | H | 390.249737 | 4923925 | 4923925.00 | 390.249726 | 0.0279 | -1 | 2 | 0.37 | 1.95 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C19H32O7 | H | 371.207523 | 11410498 | 11410498.00 | 371.207527 | -0.0106 | -1 | 4 | 0.37 | 1.68 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H28O7 | H | 367.176218 | 10197503 | 10197503.00 | 367.176227 | -0.0240 | -1 | 6 | 0.37 | 1.47 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H34O7 | H | 373.223156 | 7503142 | 7503142.00 | 373.223177 | -0.0563 | -1 | 3 | 0.37 | 1.79 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H32O7S | H | 403.179574 | 8743176 | 8743176.00 | 403.179598 | -0.0586 | -1 | 4 | 0.37 | 1.68 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H26O7 | H | 365.160544 | 6650004 | 6650004.00 | 365.160577 | -0.0897 | -1 | 7 | 0.37 | 1.37 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H26O6S | H | 345.137750 | 6134368 | 6134368.00 | 345.137733 | 0.0498 | -1 | 4 | 0.38 | 1.63 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H30O6 | H | 317.196968 | 5204774 | 5204774.00 | 317.196962 | 0.0181 | -1 | 2 | 0.38 | 1.88 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H33NO6S | H | 366.195583 | 14899541 | 14899541.00 | 366.195582 | 0.0026 | -1 | 1 | 0.38 | 2.06 | 0.063 | 0.063 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C8H15NO3 | H | 172.097915 | 12656266 | 12656266.00 | 172.097917 | -0.0110 | -1 | 2 | 0.38 | 1.88 | 0.125 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C16H26O6 | H | 313.165660 | 10092675 | 10092675.00 | 313.165662 | -0.0068 | -1 | 4 | 0.38 | 1.63 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H32O6S | H | 351.184677 | 10127141 | 10127141.00 | 351.184683 | -0.0171 | -1 | 1 | 0.38 | 2.00 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H22O6 | H | 309.134354 | 5082860 | 5082860.00 | 309.134362 | -0.0258 | -1 | 6 | 0.38 | 1.38 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H24O6 | H | 311.150004 | 7666577 | 7666577.00 | 311.150012 | -0.0259 | -1 | 5 | 0.38 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H31NO6S | H | 364.179923 | 4503502 | 4503502.00 | 364.179932 | -0.0246 | -1 | 2 | 0.38 | 1.94 | 0.063 | 0.063 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C16H28O6 | H | 315.181303 | 17417656 | 17417656.00 | 315.181312 | -0.0291 | -1 | 3 | 0.38 | 1.75 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H24O6S | H | 343.122052 | 4396408 | 4396408.00 | 343.122083 | -0.0896 | -1 | 5 | 0.38 | 1.50 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H30O6S | H | 349.168995 | 4424512 | 4424512.00 | 349.169033 | -0.1086 | -1 | 2 | 0.38 | 1.88 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C21H36O8 | H | 415.233771 | 5580791 | 5580791.00 | 415.233742 | 0.0706 | -1 | 4 | 0.38 | 1.71 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C21H34O8 | H | 413.218104 | 6022355 | 6022355.00 | 413.218092 | 0.0300 | -1 | 5 | 0.38 | 1.62 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H16O5 | H | 251.092521 | 4389363 | 4389363.00 | 251.092497 | 0.0949 | -1 | 6 | 0.38 | 1.23 | 0.000 | 0.000 | 0.13 | CHO |
| 2015-05-02 | 2015-05-05 | C13H18O5 | H | 253.108150 | 6587241 | 6587241.00 | 253.108147 | 0.0109 | -1 | 5 | 0.38 | 1.38 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H24O5 | H | 259.155092 | 8967286 | 8967286.00 | 259.155097 | -0.0209 | -1 | 2 | 0.38 | 1.85 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H32O7S | H | 391.179635 | 4924003 | 4924003.00 | 391.179598 | 0.0956 | -1 | 3 | 0.39 | 1.78 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H31NO7 | H | 372.202803 | 4627639 | 4627639.00 | 372.202776 | 0.0728 | -1 | 4 | 0.39 | 1.72 | 0.056 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H32O7 | H | 359.207539 | 8835831 | 8835831.00 | 359.207527 | 0.0336 | -1 | 3 | 0.39 | 1.78 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H25NO7 | H | 366.155829 | 4917582 | 4917582.00 | 366.155826 | 0.0090 | -1 | 7 | 0.39 | 1.39 | 0.056 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H24O7 | H | 351.144927 | 6145811 | 6145811.00 | 351.144927 | 0.0009 | -1 | 7 | 0.39 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H36O7S | H | 395.210897 | 4559867 | 4559867.00 | 395.210898 | -0.0019 | -1 | 1 | 0.39 | 2.00 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H30O7 | H | 357.191875 | 9662593 | 9662593.00 | 357.191877 | -0.0052 | -1 | 4 | 0.39 | 1.67 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H28O7 | H | 355.176224 | 10538424 | 10538424.00 | 355.176227 | -0.0079 | -1 | 5 | 0.39 | 1.56 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H16O7 | H | 343.082323 | 5309791 | 5309791.00 | 343.082326 | -0.0100 | -1 | 11 | 0.39 | 0.89 | 0.000 | 0.000 | 0.36 | CHO |
| 2015-05-02 | 2015-05-05 | C18H35NO7S | H | 408.206140 | 5029397 | 5029397.00 | 408.206147 | -0.0165 | -1 | 2 | 0.39 | 1.94 | 0.056 | 0.056 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H30O7S | H | 389.163940 | 6201791 | 6201791.00 | 389.163948 | -0.0194 | -1 | 4 | 0.39 | 1.67 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H26O7 | H | 353.160562 | 7948950 | 7948950.00 | 353.160577 | -0.0417 | -1 | 6 | 0.39 | 1.44 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H34O7S | H | 393.195231 | 4743968 | 4743968.00 | 393.195248 | -0.0424 | -1 | 2 | 0.39 | 1.89 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H24O6S | H | 331.122114 | 5235703 | 5235703.00 | 331.122083 | 0.0944 | -1 | 4 | 0.40 | 1.60 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C20H27NO8 | H | 408.166409 | 6770185 | 6770185.00 | 408.166390 | 0.0456 | -1 | 8 | 0.40 | 1.35 | 0.050 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C10H18O4 | H | 201.113245 | 5234911 | 5234911.00 | 201.113233 | 0.0616 | -1 | 2 | 0.40 | 1.80 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H28O8 | H | 395.171152 | 4768758 | 4768758.00 | 395.171141 | 0.0268 | -1 | 7 | 0.40 | 1.40 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C10H16O4 | H | 199.097593 | 3866790 | 3866790.00 | 199.097583 | 0.0525 | -1 | 3 | 0.40 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H30O8 | H | 397.186801 | 6014198 | 6014198.00 | 397.186791 | 0.0239 | -1 | 6 | 0.40 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H34O8 | H | 401.218098 | 6752127 | 6752127.00 | 401.218092 | 0.0159 | -1 | 4 | 0.40 | 1.70 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H30O6S | H | 337.169038 | 7759247 | 7759247.00 | 337.169033 | 0.0150 | -1 | 1 | 0.40 | 2.00 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H28O6 | H | 303.181316 | 4586308 | 4586308.00 | 303.181312 | 0.0126 | -1 | 2 | 0.40 | 1.87 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H26O6 | H | 301.165662 | 15648804 | 15648804.00 | 301.165662 | -0.0004 | -1 | 3 | 0.40 | 1.73 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H26O6S | H | 333.137729 | 6506990 | 6506990.00 | 333.137733 | -0.0114 | -1 | 3 | 0.40 | 1.73 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H28O6S | H | 335.153367 | 5152719 | 5152719.00 | 335.153383 | -0.0473 | -1 | 2 | 0.40 | 1.87 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H24O6 | H | 299.149991 | 10356092 | 10356092.00 | 299.150012 | -0.0704 | -1 | 4 | 0.40 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C20H32O8 | H | 399.202409 | 5920289 | 5920289.00 | 399.202442 | -0.0815 | -1 | 5 | 0.40 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H32O7S | H | 379.179626 | 5742370 | 5742370.00 | 379.179598 | 0.0748 | -1 | 2 | 0.41 | 1.88 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H30O7S | H | 377.163954 | 5951115 | 5951115.00 | 377.163948 | 0.0171 | -1 | 3 | 0.41 | 1.76 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H28O7 | H | 343.176225 | 12817819 | 12817819.00 | 343.176227 | -0.0052 | -1 | 4 | 0.41 | 1.65 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H30O7 | H | 345.191874 | 8182401 | 8182401.00 | 345.191877 | -0.0083 | -1 | 3 | 0.41 | 1.76 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H24O7 | H | 339.144921 | 8137482 | 8137482.00 | 339.144927 | -0.0167 | -1 | 6 | 0.41 | 1.41 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H34O7S | H | 381.195242 | 5939115 | 5939115.00 | 381.195248 | -0.0149 | -1 | 1 | 0.41 | 2.00 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H29NO7S | H | 390.159189 | 18162190 | 18162190.00 | 390.159197 | -0.0193 | -1 | 4 | 0.41 | 1.71 | 0.059 | 0.059 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C17H26O7 | H | 341.160564 | 10162288 | 10162288.00 | 341.160577 | -0.0373 | -1 | 5 | 0.41 | 1.53 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H18O5 | H | 241.108151 | 4915202 | 4915202.00 | 241.108147 | 0.0156 | -1 | 4 | 0.42 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H16O5 | H | 239.092499 | 6021588 | 6021588.00 | 239.092497 | 0.0076 | -1 | 5 | 0.42 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H25NO5S | H | 294.138064 | 5230889 | 5230889.00 | 294.138067 | -0.0107 | -1 | 1 | 0.42 | 2.08 | 0.083 | 0.083 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C12H20O5 | H | 243.123786 | 5504321 | 5504321.00 | 243.123797 | -0.0465 | -1 | 3 | 0.42 | 1.67 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H26O8 | H | 381.155529 | 4575144 | 4575144.00 | 381.155491 | 0.0988 | -1 | 7 | 0.42 | 1.37 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H34O8S | H | 421.190174 | 4506214 | 4506214.00 | 421.190162 | 0.0278 | -1 | 3 | 0.42 | 1.79 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H32O8 | H | 387.202449 | 9281841 | 9281841.00 | 387.202442 | 0.0192 | -1 | 4 | 0.42 | 1.68 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H28O8 | H | 383.171146 | 8855594 | 8855594.00 | 383.171141 | 0.0119 | -1 | 6 | 0.42 | 1.47 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H36O8S | H | 423.205815 | 5518912 | 5518912.00 | 423.205812 | 0.0062 | -1 | 2 | 0.42 | 1.89 | 0.000 | 0.053 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C19H30O8 | H | 385.186788 | 7954603 | 7954603.00 | 385.186791 | -0.0091 | -1 | 5 | 0.42 | 1.58 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H31NO8 | H | 400.197642 | 4716231 | 4716231.00 | 400.197691 | -0.1213 | -1 | 5 | 0.42 | 1.63 | 0.053 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C14H26O6 | H | 289.165678 | 4241467 | 4241467.00 | 289.165662 | 0.0549 | -1 | 2 | 0.43 | 1.86 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H24O6 | H | 287.150015 | 13131945 | 13131945.00 | 287.150012 | 0.0103 | -1 | 3 | 0.43 | 1.71 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H28O6S | H | 323.153382 | 4713517 | 4713517.00 | 323.153383 | -0.0027 | -1 | 1 | 0.43 | 2.00 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C14H26O6S | H | 321.137731 | 4462153 | 4462153.00 | 321.137733 | -0.0056 | -1 | 2 | 0.43 | 1.86 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C23H9NO10 | H | 458.015265 | 4836059 | 4836059.00 | 458.015369 | -0.2272 | -1 | 20 | 0.43 | 0.39 | 0.043 | 0.000 | 0.79 | CHON |
| 2015-05-02 | 2015-05-05 | C16H20O7 | H | 323.113639 | 4840463 | 4840463.00 | 323.113627 | 0.0385 | -1 | 7 | 0.44 | 1.25 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H32O7S | H | 367.179608 | 7436800 | 7436800.00 | 367.179598 | 0.0283 | -1 | 1 | 0.44 | 2.00 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H28O7 | H | 331.176237 | 8811552 | 8811552.00 | 331.176227 | 0.0308 | -1 | 3 | 0.44 | 1.75 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H25NO7 | H | 342.155830 | 5616389 | 5616389.00 | 342.155826 | 0.0125 | -1 | 5 | 0.44 | 1.56 | 0.063 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C16H28O7S | H | 363.148295 | 12064495 | 12064495.00 | 363.148297 | -0.0069 | -1 | 3 | 0.44 | 1.75 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H26O7 | H | 329.160559 | 9354778 | 9354778.00 | 329.160577 | -0.0539 | -1 | 4 | 0.44 | 1.63 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H30O7S | H | 365.163927 | 7850132 | 7850132.00 | 365.163948 | -0.0563 | -1 | 2 | 0.44 | 1.88 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H24O7 | H | 327.144904 | 8222736 | 8222736.00 | 327.144927 | -0.0693 | -1 | 5 | 0.44 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H22O7 | H | 325.129241 | 6935049 | 6935049.00 | 325.129277 | -0.1095 | -1 | 6 | 0.44 | 1.38 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H23NO7 | H | 340.140139 | 4713916 | 4713916.00 | 340.140176 | -0.1077 | -1 | 6 | 0.44 | 1.44 | 0.063 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C18H30O8S | H | 405.158900 | 5712594 | 5712594.00 | 405.158862 | 0.0934 | -1 | 4 | 0.44 | 1.67 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H34O8S | H | 409.190187 | 4939591 | 4939591.00 | 409.190162 | 0.0603 | -1 | 2 | 0.44 | 1.89 | 0.000 | 0.056 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H28O8 | H | 371.171164 | 7814205 | 7814205.00 | 371.171141 | 0.0608 | -1 | 5 | 0.44 | 1.56 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H24O8 | H | 367.139861 | 5036537 | 5036537.00 | 367.139841 | 0.0537 | -1 | 7 | 0.44 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C9H19NO4S | H | 236.096204 | 91647696 | 100194701.00 | 236.096202 | 0.0070 | -1 | 1 | 0.44 | 2.11 | 0.111 | 0.111 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C18H26O8 | H | 369.155490 | 6830898 | 6830898.00 | 369.155491 | -0.0037 | -1 | 6 | 0.44 | 1.44 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C9H14O4 | H | 185.081929 | 4320964 | 4320964.00 | 185.081932 | -0.0188 | -1 | 3 | 0.44 | 1.56 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H30O8 | H | 373.186780 | 7318818 | 7318818.00 | 373.186791 | -0.0308 | -1 | 4 | 0.44 | 1.67 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H29NO8 | H | 386.181989 | 5005548 | 5005548.00 | 386.182040 | -0.1333 | -1 | 5 | 0.44 | 1.61 | 0.056 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C20H34O9 | H | 417.213027 | 4488000 | 4488000.00 | 417.213006 | 0.0498 | -1 | 4 | 0.45 | 1.70 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C11H20O5 | H | 231.123802 | 5879814 | 5879814.00 | 231.123797 | 0.0203 | -1 | 2 | 0.45 | 1.82 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C11H23NO5S | H | 280.122417 | 5680327 | 5680327.00 | 280.122417 | -0.0003 | -1 | 1 | 0.45 | 2.09 | 0.091 | 0.091 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C11H18O5 | H | 229.108139 | 4229484 | 4229484.00 | 229.108147 | -0.0359 | -1 | 3 | 0.45 | 1.64 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H24O6 | H | 275.150027 | 5179687 | 5179687.00 | 275.150012 | 0.0543 | -1 | 2 | 0.46 | 1.85 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H20O6 | H | 271.118719 | 10132713 | 10132713.00 | 271.118712 | 0.0261 | -1 | 4 | 0.46 | 1.54 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H18O6 | H | 269.103066 | 6729397 | 6729397.00 | 269.103062 | 0.0154 | -1 | 5 | 0.46 | 1.38 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H16O6 | H | 267.087392 | 4434013 | 4434013.00 | 267.087412 | -0.0741 | -1 | 6 | 0.46 | 1.23 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H28O7S | H | 351.148315 | 6485780 | 6485780.00 | 351.148297 | 0.0499 | -1 | 2 | 0.47 | 1.87 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H20O7 | H | 311.113634 | 4836219 | 4836219.00 | 311.113627 | 0.0240 | -1 | 6 | 0.47 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H30O7S | H | 353.163954 | 4405911 | 4405911.00 | 353.163948 | 0.0182 | -1 | 1 | 0.47 | 2.00 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H24O7S | H | 347.116996 | 25345766 | 25345766.00 | 347.116997 | -0.0039 | -1 | 4 | 0.47 | 1.60 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H24O7 | H | 315.144925 | 6661535 | 6661535.00 | 315.144927 | -0.0053 | -1 | 4 | 0.47 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H26O7 | H | 317.160575 | 6552333 | 6552333.00 | 317.160577 | -0.0055 | -1 | 3 | 0.47 | 1.73 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H26O7S | H | 349.132639 | 9233197 | 9233197.00 | 349.132647 | -0.0241 | -1 | 3 | 0.47 | 1.73 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H27NO7 | H | 332.171400 | 7169812 | 7169812.00 | 332.171476 | -0.2281 | -1 | 3 | 0.47 | 1.80 | 0.067 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C17H24O8 | H | 355.139851 | 5815723 | 5815723.00 | 355.139841 | 0.0273 | -1 | 6 | 0.47 | 1.41 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H28O8 | H | 359.171138 | 7246573 | 7246573.00 | 359.171141 | -0.0095 | -1 | 4 | 0.47 | 1.65 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H26O8 | H | 357.155481 | 7872630 | 7872630.00 | 357.155491 | -0.0290 | -1 | 5 | 0.47 | 1.53 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H32O8S | H | 395.174501 | 7185399 | 7185399.00 | 395.174512 | -0.0284 | -1 | 2 | 0.47 | 1.88 | 0.000 | 0.059 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H30O8 | H | 361.186777 | 5297431 | 5297431.00 | 361.186791 | -0.0401 | -1 | 3 | 0.47 | 1.76 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C17H22O8 | H | 353.124171 | 4848262 | 4848262.00 | 353.124191 | -0.0573 | -1 | 7 | 0.47 | 1.29 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H26O9 | H | 397.150441 | 4723953 | 4723953.00 | 397.150406 | 0.0882 | -1 | 7 | 0.47 | 1.37 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C19H28O9 | H | 399.166037 | 5326364 | 5326364.00 | 399.166056 | -0.0477 | -1 | 6 | 0.47 | 1.47 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H18O6 | H | 257.103079 | 6988955 | 6988955.00 | 257.103062 | 0.0667 | -1 | 4 | 0.50 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C10H18O5S | H | 249.080233 | 6354904 | 6354904.00 | 249.080218 | 0.0605 | -1 | 2 | 0.50 | 1.80 | 0.000 | 0.100 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C16H28O8S | H | 379.143227 | 5426975 | 5426975.00 | 379.143212 | 0.0393 | -1 | 3 | 0.50 | 1.75 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C12H16O6 | H | 255.087425 | 5708868 | 5708868.00 | 255.087412 | 0.0518 | -1 | 5 | 0.50 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C18H28O9 | H | 387.166067 | 5964079 | 5964079.00 | 387.166056 | 0.0283 | -1 | 5 | 0.50 | 1.56 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H22O7 | H | 301.129287 | 6117398 | 6117398.00 | 301.129277 | 0.0345 | -1 | 4 | 0.50 | 1.57 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H26O7S | H | 337.132657 | 4498805 | 4498805.00 | 337.132647 | 0.0284 | -1 | 2 | 0.50 | 1.86 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C10H16O5 | H | 215.092506 | 3918246 | 3918246.00 | 215.092497 | 0.0410 | -1 | 3 | 0.50 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H20O7 | H | 299.113635 | 7906673 | 7906673.00 | 299.113627 | 0.0283 | -1 | 5 | 0.50 | 1.43 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H30O8S | H | 381.158870 | 7962536 | 7962536.00 | 381.158862 | 0.0205 | -1 | 2 | 0.50 | 1.88 | 0.000 | 0.063 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C18H26O9 | H | 385.150413 | 5779625 | 5779625.00 | 385.150406 | 0.0182 | -1 | 6 | 0.50 | 1.44 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H24O8 | H | 343.139848 | 9139587 | 9139587.00 | 343.139841 | 0.0195 | -1 | 5 | 0.50 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H20O6 | H | 259.118718 | 5491832 | 5491832.00 | 259.118712 | 0.0235 | -1 | 3 | 0.50 | 1.67 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H22O8 | H | 341.124196 | 7811160 | 7811160.00 | 341.124191 | 0.0140 | -1 | 6 | 0.50 | 1.38 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H24O7 | H | 303.144926 | 6101813 | 6101813.00 | 303.144927 | -0.0022 | -1 | 3 | 0.50 | 1.71 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H24O6S | H | 295.122080 | 16507324 | 16507324.00 | 295.122083 | -0.0093 | -1 | 1 | 0.50 | 2.00 | 0.000 | 0.083 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C14H19NO7 | H | 312.108864 | 4498915 | 4498915.00 | 312.108876 | -0.0369 | -1 | 6 | 0.50 | 1.36 | 0.071 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C8H12O4 | H | 171.066269 | 3957152 | 3957152.00 | 171.066282 | -0.0785 | -1 | 3 | 0.50 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C8H6O4 | H | 165.019317 | 3862126 | 3862126.00 | 165.019332 | -0.0923 | -1 | 6 | 0.50 | 0.75 | 0.000 | 0.000 | 0.50 | CHO |
| 2015-05-02 | 2015-05-05 | C16H28O8 | H | 347.171123 | 7155461 | 7155461.00 | 347.171141 | -0.0531 | -1 | 3 | 0.50 | 1.75 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H25NO6S | H | 310.132958 | 4817199 | 4817199.00 | 310.132982 | -0.0767 | -1 | 1 | 0.50 | 2.08 | 0.083 | 0.083 | 0.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C16H26O8 | H | 345.155466 | 8882795 | 8882795.00 | 345.155491 | -0.0735 | -1 | 4 | 0.50 | 1.63 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H28O7S | H | 339.148262 | 4754189 | 4754189.00 | 339.148297 | -0.1046 | -1 | 1 | 0.50 | 2.00 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C17H24O9 | H | 371.134775 | 5479481 | 5479481.00 | 371.134756 | 0.0514 | -1 | 6 | 0.53 | 1.41 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H23NO8 | H | 344.135130 | 4438009 | 4438009.00 | 344.135090 | 0.1155 | -1 | 5 | 0.53 | 1.53 | 0.067 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C15H24O8 | H | 331.139858 | 5882884 | 5882884.00 | 331.139841 | 0.0504 | -1 | 4 | 0.53 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H26O8S | H | 365.127575 | 7288973 | 7288973.00 | 365.127562 | 0.0355 | -1 | 3 | 0.53 | 1.73 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C15H22O8 | H | 329.124198 | 5910015 | 5910015.00 | 329.124191 | 0.0206 | -1 | 5 | 0.53 | 1.47 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H20O8 | H | 327.108543 | 4528116 | 4528116.00 | 327.108541 | 0.0056 | -1 | 6 | 0.53 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H28O8S | H | 367.143209 | 4913658 | 4913658.00 | 367.143212 | -0.0085 | -1 | 2 | 0.53 | 1.87 | 0.000 | 0.067 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C13H20O7 | H | 287.113639 | 6553772 | 6553772.00 | 287.113627 | 0.0434 | -1 | 4 | 0.54 | 1.54 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H22O7 | H | 289.129289 | 6135868 | 6135868.00 | 289.129277 | 0.0429 | -1 | 3 | 0.54 | 1.69 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H18O7 | H | 285.097960 | 5087614 | 5087614.00 | 285.097976 | -0.0578 | -1 | 5 | 0.54 | 1.38 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C11H18O6 | H | 245.103076 | 4481421 | 4481421.00 | 245.103062 | 0.0577 | -1 | 3 | 0.55 | 1.64 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C11H16O6 | H | 243.087409 | 6780203 | 6780203.00 | 243.087412 | -0.0115 | -1 | 4 | 0.55 | 1.45 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C9H12O5 | H | 199.061205 | 6703215 | 6703215.00 | 199.061197 | 0.0400 | -1 | 4 | 0.56 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C9H14O5 | H | 201.076855 | 5487270 | 5487270.00 | 201.076847 | 0.0393 | -1 | 3 | 0.56 | 1.56 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H24O9 | H | 359.134753 | 5685986 | 5685986.00 | 359.134756 | -0.0081 | -1 | 5 | 0.56 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C16H22O9 | H | 357.119088 | 5410921 | 5410921.00 | 357.119106 | -0.0500 | -1 | 6 | 0.56 | 1.38 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H18O8 | H | 313.092884 | 6701140 | 6701140.00 | 313.092891 | -0.0227 | -1 | 6 | 0.57 | 1.29 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H22O8 | H | 317.124182 | 6286067 | 6286067.00 | 317.124191 | -0.0291 | -1 | 4 | 0.57 | 1.57 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H26O8S | H | 353.127547 | 5495432 | 5495432.00 | 353.127562 | -0.0426 | -1 | 2 | 0.57 | 1.86 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C14H20O8 | H | 315.108523 | 6059399 | 6059399.00 | 315.108541 | -0.0577 | -1 | 5 | 0.57 | 1.43 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H16O7 | H | 271.082335 | 6208754 | 6208754.00 | 271.082326 | 0.0317 | -1 | 5 | 0.58 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H18O7 | H | 273.097977 | 4770580 | 4770580.00 | 273.097976 | 0.0019 | -1 | 4 | 0.58 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H20O7 | H | 275.113617 | 5278000 | 5278000.00 | 275.113627 | -0.0347 | -1 | 3 | 0.58 | 1.67 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H17NO7 | H | 286.093200 | 4471051 | 4471051.00 | 286.093225 | -0.0890 | -1 | 5 | 0.58 | 1.42 | 0.083 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C10H16O6 | H | 231.087418 | 6488022 | 6488022.00 | 231.087412 | 0.0269 | -1 | 3 | 0.60 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C10H14O6 | H | 229.071764 | 7363897 | 7363897.00 | 229.071762 | 0.0099 | -1 | 4 | 0.60 | 1.40 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C15H22O9 | H | 345.119071 | 5298773 | 5298773.00 | 345.119106 | -0.1010 | -1 | 5 | 0.60 | 1.47 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H24O8S | H | 339.111919 | 6863603 | 6863603.00 | 339.111912 | 0.0207 | -1 | 2 | 0.62 | 1.85 | 0.000 | 0.077 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C13H18O8 | H | 301.092850 | 5541897 | 5541897.00 | 301.092891 | -0.1365 | -1 | 5 | 0.62 | 1.38 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C8H13NO5 | H | 202.072104 | 4323033 | 4323033.00 | 202.072096 | 0.0392 | -1 | 3 | 0.63 | 1.63 | 0.125 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C8H12O5 | H | 187.061197 | 14942591 | 14942591.00 | 187.061197 | -0.0002 | -1 | 3 | 0.63 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C11H18O7 | H | 261.097989 | 4555757 | 4555757.00 | 261.097976 | 0.0480 | -1 | 3 | 0.64 | 1.64 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C11H16O7 | H | 259.082334 | 6730874 | 6730874.00 | 259.082326 | 0.0293 | -1 | 4 | 0.64 | 1.45 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C14H20O9S | H | 363.075509 | 4495071 | 4495071.00 | 363.075526 | -0.0481 | -1 | 5 | 0.64 | 1.43 | 0.000 | 0.071 | 0.00 | CHOS |
| 2015-05-02 | 2015-05-05 | C9H14O6 | H | 217.071764 | 6735613 | 6735613.00 | 217.071762 | 0.0105 | -1 | 3 | 0.67 | 1.56 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C9H12O6 | H | 215.056110 | 5368167 | 5368167.00 | 215.056112 | -0.0077 | -1 | 4 | 0.67 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H16O8 | H | 287.077236 | 4845743 | 4845743.00 | 287.077241 | -0.0176 | -1 | 5 | 0.67 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C13H18O9 | H | 317.087795 | 4418266 | 4418266.00 | 317.087806 | -0.0338 | -1 | 5 | 0.69 | 1.38 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C10H14O7 | H | 245.066672 | 6611323 | 6611323.00 | 245.066676 | -0.0178 | -1 | 4 | 0.70 | 1.40 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C10H16O7 | H | 247.082321 | 4758798 | 4758798.00 | 247.082326 | -0.0219 | -1 | 3 | 0.70 | 1.60 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C10H12O7 | H | 243.051009 | 5037333 | 5037333.00 | 243.051026 | -0.0711 | -1 | 5 | 0.70 | 1.20 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C7H10O5 | H | 173.045537 | 6182041 | 6182041.00 | 173.045547 | -0.0577 | -1 | 3 | 0.71 | 1.43 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C11H14O8 | H | 273.061597 | 6122269 | 6122269.00 | 273.061591 | 0.0221 | -1 | 5 | 0.73 | 1.27 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C8H12O6 | H | 203.056127 | 9991444 | 9991444.00 | 203.056112 | 0.0755 | -1 | 3 | 0.75 | 1.50 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C8H10O6 | H | 201.040473 | 3834988 | 3834988.00 | 201.040462 | 0.0567 | -1 | 4 | 0.75 | 1.25 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C12H15NO9 | H | 316.067356 | 4478997 | 4478997.00 | 316.067405 | -0.1539 | -1 | 6 | 0.75 | 1.25 | 0.083 | 0.000 | 0.00 | CHON |
| 2015-05-02 | 2015-05-05 | C9H14O7 | H | 233.066685 | 4364680 | 4364680.00 | 233.066676 | 0.0371 | -1 | 3 | 0.78 | 1.56 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C9H12O7 | H | 231.051033 | 5956519 | 5956519.00 | 231.051026 | 0.0291 | -1 | 4 | 0.78 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C10H14O8 | H | 261.061599 | 6321136 | 6321136.00 | 261.061591 | 0.0307 | -1 | 4 | 0.80 | 1.40 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C10H12O8 | H | 259.045940 | 4355195 | 4355195.00 | 259.045941 | -0.0035 | -1 | 5 | 0.80 | 1.20 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C7H10O6 | H | 189.040471 | 4792372 | 4792372.00 | 189.040462 | 0.0497 | -1 | 3 | 0.86 | 1.43 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C8H10N4O7S | H | 305.019683 | 124882560 | 132800233.00 | 305.019743 | -0.1965 | -1 | 6 | 0.88 | 1.25 | 0.500 | 0.125 | 1.00 | CHONS |
| 2015-05-02 | 2015-05-05 | C9H12O8 | H | 247.045942 | 4748543 | 4748543.00 | 247.045941 | 0.0044 | -1 | 4 | 0.89 | 1.33 | 0.000 | 0.000 | 0.00 | CHO |
| 2015-05-02 | 2015-05-05 | C5H10O5S2 | H | 212.989683 | 7163742 | 7163742.00 | 212.989688 | -0.0252 | -1 | 1 | 1.00 | 2.00 | 0.000 | 0.400 | 3.00 | CHOS |
| 2015-05-02 | 2015-05-05 | *This dataset is one of the triplicate. |