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Name
Formula / Structure
ExactMass
ID
5-Methylcytidine
8 spectra
C10H15N3O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
257.10117
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80503
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80502
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01751
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01784
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01762
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01773
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80501
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80500
5-Methyltryptamine
4 spectra
C11H14N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.11569
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01281
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01287
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01293
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80505
6,7-Dimethoxy-4-methylcoumarin
5 spectra
C12H12O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
220.07356
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80512
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01187
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01193
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01199
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80510
6-Azauridine
2 spectra
C8H11N3O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
245.06479
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80523
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80521
6-Bromo-2-naphthyl-beta-D-galactopyranoside
6 spectra
C16H17BrO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
384.02084
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80528
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01732
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01739
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01746
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80526
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80525
6-Bromo-3'-methylflavone
5 spectra
C16H11BrO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
313.99423
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80532
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01543
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01555
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01567
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80530
6-Chloropurine riboside
4 spectra
C10H11ClN4O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.04688
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80538
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80537
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80536
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80535
6-Ethoxy-3(4'-hydroxyphenyl)-4-methylcoumarin
10 spectra
C18H16O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
296.10486
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80543
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80542
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01707
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01734
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01716
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01741
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01725
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01748
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80541
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80540
6-Fluoro-DL-tryptophan
10 spectra
C11H11FN2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
222.08046
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80548
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80547
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01533
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01569
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01545
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01576
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01557
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01583
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80546
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80545
6-Hydroxy-4-methylcoumarin, 6-Hydroxy-4-methyl-2-b...
10 spectra
C10H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
176.04735
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80553
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80552
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01379
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01406
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01388
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01412
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01397
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01418
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80551
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80550
6-methoxy-2-oxo-2H-chromen-7-yl 2-O-acetyl-6-O-(6-...
7 spectra
C24H30O14
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
542.16357
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80558
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80557
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01537
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01549
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01561
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80556
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80555
6-Methylflavone
5 spectra
C16H12O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
236.08372
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80562
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01258
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01264
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01270
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80560
6-Methylflavonol
5 spectra
C16H12O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
252.07864
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80567
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00285
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00294
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00303
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80565
6a,12a-Didehydroamorphigenin
8 spectra
C23H20O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
408.12091
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80518
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80517
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00166
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00207
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00180
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00220
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80516
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80515
7,3'-Dihydroxyflavone
10 spectra
C15H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
254.05791
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80573
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80572
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00239
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00259
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00246
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00266
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00253
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00273
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80571
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80570
7,8-Benzoflavone
4 spectra
C19H12O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
272.08374
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80577
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00242
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00249
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80575
7-acetyloxy-2-(3,4-diacetyloxyphenyl)-4-oxochromen...
5 spectra
C23H18O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
454.09000
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80582
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00106
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00118
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00130
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80580
7-amino-8-(2,4-dihydroxy-6-methylphenyl)-1,9-dimet...
7 spectra
C21H18N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
362.12665
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80588
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80587
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00746
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00753
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00760
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80586
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80585
7-Benzyloxygramine
2 spectra
C18H20N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
280.15756
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80591
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80590
7-Benzyloxytryptamine
6 spectra
C17H18N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.14191
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80597
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01380
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01389
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01398
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80596
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80595
7-chloro-4-methyl-2-oxochromen-6-yl propanoate
5 spectra
C13H11ClO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
266.03458
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80602
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01382
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01391
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01400
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80600
7-Hydroxy-3'-methoxyflavone
10 spectra
C16H12O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
268.07355
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80608
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80607
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01474
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01515
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01489
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01523
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01504
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01531
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80606
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80605
7-Hydroxy-3-Methylflavone
6 spectra
C16H12O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
252.07864
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80613
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80612
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00334
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML00339
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80611
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80610
7-methoxy-4-methylcoumarin
5 spectra
C11H10O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
190.06299
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80617
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01256
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01262
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01268
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80615
7-Methoxyisoflavone
5 spectra
C16H12O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
252.07864
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80622
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00817
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00827
LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
MSBNK-Washington_State_Univ-BML00837
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80620
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