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898 Hit.
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Name
Formula / Structure
ExactMass
ID
(-)-Epicatechin
10 spectra
C15H14O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
290.07904
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00067
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00068
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00069
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00070
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00071
LC-ESI-QTOF; MS2; [M-H]-; CE: 10eV
FIO00072
LC-ESI-QTOF; MS2; [M-H]-; CE: 20eV
FIO00073
LC-ESI-QTOF; MS2; [M-H]-; CE: 30eV
FIO00074
LC-ESI-QTOF; MS2; [M-H]-; CE: 40eV
FIO00075
LC-ESI-QTOF; MS2; [M-H]-; CE: 50eV
FIO00076
10-Acetyl-trichoderonic-acid
5 spectra
C17H24O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
340.15219
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00840
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00841
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00842
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00843
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00844
2-Thiophenecarboxylic acid
4 spectra
C5H4O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
127.99320
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00387
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00388
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00389
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00390
3,4-Dihydrocoumarin
3 spectra
C9H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
148.05243
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00507
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00508
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00509
3-(5-Acetyl-2-furyl)-5-methoxy-2-benzofuran-1(3H)-...
10 spectra
C15H12O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
272.06848
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00357
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00358
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00359
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00360
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00361
LC-ESI-QTOF; MS2; [M-H]-; CE: 10eV
FIO00362
LC-ESI-QTOF; MS2; [M-H]-; CE: 20eV
FIO00363
LC-ESI-QTOF; MS2; [M-H]-; CE: 30eV
FIO00364
LC-ESI-QTOF; MS2; [M-H]-; CE: 40eV
FIO00365
LC-ESI-QTOF; MS2; [M-H]-; CE: 50eV
FIO00366
3-Hydroxy-beta-lapachone
5 spectra
C15H14O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
258.08920
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00297
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00298
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00299
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00300
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00301
3-Hydroxyanthranilic acid
8 spectra
C7H7NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
153.04259
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00668
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00669
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00670
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00671
LC-ESI-QTOF; MS2; [M-H]-; CE: 10eV
FIO00672
LC-ESI-QTOF; MS2; [M-H]-; CE: 20eV
FIO00673
LC-ESI-QTOF; MS2; [M-H]-; CE: 30eV
FIO00674
LC-ESI-QTOF; MS2; [M-H]-; CE: 40eV
FIO00675
3-Hydroxykynurenine
5 spectra
C10H12N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.07971
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00653
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00654
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00655
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00656
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00657
3-Thiophenecarboxylic acid
4 spectra
C5H4O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
127.99320
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00391
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00392
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00393
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00394
5,6-Dimethoxynaphtol[2,3-b]furan-4,9-dione
5 spectra
C14H10O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
258.05283
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00312
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00313
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00314
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00315
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00316
6-Acetoxy-piliformic-acid
5 spectra
C13H20O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
272.12598
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00845
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00846
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00847
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00848
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00849
6-Methylcoumarin
5 spectra
C10H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
160.05243
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00180
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00181
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00182
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00183
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00184
7-Hydroxyflavone
10 spectra
C15H10O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.06299
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00140
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00141
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00142
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00143
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00144
LC-ESI-QTOF; MS2; [M-H]-; CE: 10eV
FIO00145
LC-ESI-QTOF; MS2; [M-H]-; CE: 20eV
FIO00146
LC-ESI-QTOF; MS2; [M-H]-; CE: 30eV
FIO00147
LC-ESI-QTOF; MS2; [M-H]-; CE: 40eV
FIO00148
LC-ESI-QTOF; MS2; [M-H]-; CE: 50eV
FIO00149
Adenosine
5 spectra
C10H13N5O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
267.09674
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00683
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00684
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00685
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00686
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00687
Aesculetin
8 spectra
C9H6O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
178.02661
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00077
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00078
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00079
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00080
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00081
LC-ESI-QTOF; MS2; [M-H]-; CE: 10eV
FIO00082
LC-ESI-QTOF; MS2; [M-H]-; CE: 20eV
FIO00083
LC-ESI-QTOF; MS2; [M-H]-; CE: 30eV
FIO00084
Afzelin
10 spectra
C21H20O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
432.10565
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00758
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00759
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00760
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00761
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00762
LC-ESI-QTOF; MS2; [M-H]-; CE: 10eV
FIO00763
LC-ESI-QTOF; MS2; [M-H]-; CE: 20eV
FIO00764
LC-ESI-QTOF; MS2; [M-H]-; CE: 30eV
FIO00765
LC-ESI-QTOF; MS2; [M-H]-; CE: 40eV
FIO00766
LC-ESI-QTOF; MS2; [M-H]-; CE: 50eV
FIO00767
Ajmalicine
5 spectra
C21H24N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
352.17868
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00001
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00002
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00003
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00004
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00005
Allopurinol
5 spectra
C5H4N4O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
136.03851
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00455
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00456
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00457
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00458
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00459
Amitryptiline
5 spectra
C20H23N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
277.18304
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00473
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00474
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00475
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00476
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00477
Anhydrocochlioquinone A
5 spectra
C30H42O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
514.29303
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00768
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00769
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00770
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00771
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00772
Apigenin
10 spectra
C15H10O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
270.05283
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00006
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00007
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00008
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00009
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00010
LC-ESI-QTOF; MS2; [M-H]-; CE: 10eV
FIO00011
LC-ESI-QTOF; MS2; [M-H]-; CE: 20eV
FIO00012
LC-ESI-QTOF; MS2; [M-H]-; CE: 30eV
FIO00013
LC-ESI-QTOF; MS2; [M-H]-; CE: 40eV
FIO00014
LC-ESI-QTOF; MS2; [M-H]-; CE: 50eV
FIO00015
Artemisinin
5 spectra
C15H22O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
282.14673
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00415
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00416
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00417
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00418
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00419
Beauvericin
5 spectra
C45H57N3O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
783.40948
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00693
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00694
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00695
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00696
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00697
Betaine
2 spectra
[C5H12NO2]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
118.08626
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00887
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00888
Biotin
7 spectra
C10H16N2O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
244.08817
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
FIO00016
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
FIO00017
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
FIO00018
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
FIO00019
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
FIO00020
LC-ESI-QTOF; MS2; [M-H]-; CE: 10eV
FIO00021
LC-ESI-QTOF; MS2; [M-H]-; CE: 20eV
FIO00022
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