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Name
Formula / Structure
ExactMass
ID
Thiamine
1 spectrum
[C12H17N4OS]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
265.35950
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000299
Trachelanthamine
4 spectra
C15H27NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
285.38669
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00147
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00146
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00145
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00148
Trachelanthine
5 spectra
C15H27NO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
301.38611
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00327
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00326
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00325
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00328
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000040
Trichodesmine
5 spectra
C18H27NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
353.41901
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02055
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02054
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02053
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02056
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000044
Tschimganin
5 spectra
C18H24O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
304.38959
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA00887
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA00886
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA00885
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA00888
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000456
Tubeimoside I
1 spectrum
C63H98O29
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
1319.46606
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000492
tubermycin B
1 spectrum
C13H8N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.22090
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000108
turkesterone
8 spectra
C27H44O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
496.64691
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03387
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HOO]-
MSBNK-RIKEN_NPDepo-NGA05220
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03386
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HOO]-
MSBNK-RIKEN_NPDepo-NGA05221
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03385
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HOO]-
MSBNK-RIKEN_NPDepo-NGA05222
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03388
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HOO]-
MSBNK-RIKEN_NPDepo-NGA05219
Ugaferin
5 spectra
C25H36O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
448.56149
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01403
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01402
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01401
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01404
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000335
urolithin B
5 spectra
C13H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
212.20689
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03090
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03091
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03092
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03089
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000240
Ursinoic acid
5 spectra
C15H16O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
276.29181
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00710
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00711
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00712
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00709
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000460
Usnone A
5 spectra
C18H16O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
344.32401
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01931
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01930
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01929
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01932
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000461
Vanilloside
4 spectra
C14H18O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
314.29480
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02178
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02179
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02180
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02177
Veraflorizine
4 spectra
C27H43NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
413.64929
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01342
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01343
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01344
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01341
Veratroylzygadenine
8 spectra
C36H51NO10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
657.80859
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02459
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04630
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02458
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04631
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02457
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04632
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02460
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04629
Versicoside
5 spectra
C32H42O15
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
666.68250
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04559
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04558
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04557
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04560
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000402
Verticinone
5 spectra
C27H45NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
447.66400
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01351
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01350
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01349
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01352
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000163
Vidarabine phosphate
5 spectra
C10H13N5NaO7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
369.20801
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01815
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01814
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01813
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01816
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000295
Vinblastine sulfate
1 spectrum
C46H60N4O13S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
909.07410
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000076
Vincadifformine
6 spectra
C21H26N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
338.45361
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01010
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01011
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01012
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01009
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000130
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000131
Vincanidine
10 spectra
C19H20N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
308.38351
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00302
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02638
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00303
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02639
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00304
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02640
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00301
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02637
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000126
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000127
Vincristine sulfate
1 spectrum
C46H58N4O14S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
923.05762
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000075
Vinervine
5 spectra
C20H22N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
338.40991
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02203
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02202
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02201
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02204
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000138
Visnadine
1 spectrum
C21H24O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
388.42120
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000251
Vulgarin
5 spectra
C15H20O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
264.32431
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01319
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01318
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01317
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01320
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000438
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