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1,956 Hit.
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Name
Formula / Structure
ExactMass
ID
angelicin
5 spectra
C11H6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
186.16870
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03270
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03271
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03272
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03269
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000245
Anthranoyllycoctonine
10 spectra
C32H46N2O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
586.73199
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00730
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02386
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00731
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02387
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00732
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02388
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00729
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02385
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000184
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000185
Artemisinin
5 spectra
C15H22O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
282.33960
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01731
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01730
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01729
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01732
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000441
Asiaticoside
9 spectra
C48H78O19
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
959.14551
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02707
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04790
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02706
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04791
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02705
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04792
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02708
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04789
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000490
astragaloside IV
5 spectra
C41H68O14
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
784.99072
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA05145
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA05144
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA05143
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA05146
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000486
Aucubin
9 spectra
C15H22O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
346.33719
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04111
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA01118
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04110
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA01119
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04109
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA01120
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA04112
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA01117
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000430
Auraptene
5 spectra
C19H22O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
298.38541
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01954
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01955
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01956
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01953
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000250
Austricin
5 spectra
C15H18O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
262.30829
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00539
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00538
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00537
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00540
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000435
Avermectin B1a
5 spectra
C48H72O14
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
873.10059
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02714
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02715
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02716
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02713
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000351
Badrakemin acetate
4 spectra
C26H32O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
424.54190
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA01899
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA01898
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA01897
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA01900
Barbatic acid
5 spectra
C19H20O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
360.36710
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02315
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02314
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02313
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+Na]+
MSBNK-RIKEN_NPDepo-NGA02316
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000267
Benzylpenicillin
1 spectrum
C16H18N2O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
334.39691
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000211
Berberine
1 spectrum
[C20H18NO4]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
336.37079
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000105
Betulafolienetriol
4 spectra
C30H52O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
460.74710
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [2M+H]+
MSBNK-RIKEN_NPDepo-NGA02898
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [2M+H]+
MSBNK-RIKEN_NPDepo-NGA02899
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [2M+H]+
MSBNK-RIKEN_NPDepo-NGA02900
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [2M+H]+
MSBNK-RIKEN_NPDepo-NGA02897
betulonaldehyde
4 spectra
C30H46O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
438.69989
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03323
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03322
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03321
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03324
Bicuculline
5 spectra
C20H17NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
367.36160
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01827
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01826
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01825
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01828
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000102
Bilirubin Ixalpha
4 spectra
C33H36N4O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
584.67810
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00459
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00458
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00457
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00460
Boldenone
5 spectra
C19H26O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.41791
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01979
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01978
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01977
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01980
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000376
Boldine
5 spectra
C19H21NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
327.38351
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00418
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00419
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00420
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00417
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000103
Bovoside A
8 spectra
C31H44O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
560.69092
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03406
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HOO]-
MSBNK-RIKEN_NPDepo-NGA05241
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03407
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HOO]-
MSBNK-RIKEN_NPDepo-NGA05240
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03408
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HOO]-
MSBNK-RIKEN_NPDepo-NGA05239
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA03405
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HOO]-
MSBNK-RIKEN_NPDepo-NGA05242
Brevicarine
5 spectra
C17H21N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
267.37701
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00207
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00206
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00205
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00208
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000064
Brevicarine, N-Ac
4 spectra
C19H23N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
309.41470
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01582
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01583
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01584
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA01581
Bryoamaride
9 spectra
C36H54O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
678.82458
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA03527
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M-OH]+
MSBNK-RIKEN_NPDepo-NGA00114
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA03526
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M-OH]+
MSBNK-RIKEN_NPDepo-NGA00115
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA03525
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M-OH]+
MSBNK-RIKEN_NPDepo-NGA00116
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
MSBNK-RIKEN_NPDepo-NGA03528
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M-OH]+
MSBNK-RIKEN_NPDepo-NGA00113
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000482
Bucharaine
5 spectra
C19H25NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
331.41541
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00371
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00370
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00369
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00372
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000020
Canescein,(3,5,11,14,19-Pentahydroxycard-20(22)-en...
1 spectrum
C29H42O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
566.65149
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000356
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