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LC-ESI-QFT
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14,435 Hit.
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Name
Formula / Structure
ExactMass
ID
(-)-Epigallocatechin gallate
9 spectra
C22H18O11
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
458.08490
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU080801
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU080851
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU080852
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU080803
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU080853
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU080804
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU080854
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU080855
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU080856
(1,1-Dimethylethyl)urea
6 spectra
C5H12N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
116.09500
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU105601
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU105602
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU105603
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU105604
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU105605
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU105606
(4-Aminophenyl)arsonic acid
12 spectra
C6H8AsNO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
216.97200
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU040601
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU040651
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU040602
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU040652
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU040603
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU040653
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU040604
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU040654
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU040605
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU040655
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU040606
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU040656
(4-Methylphenoxy) acetic acid ethyl ester
6 spectra
C11H14O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
194.09430
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU093451
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU093452
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU093453
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU093454
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU093455
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU093456
(9Z,12R)-12-Hydroxyoctadec-9-enoic acid
6 spectra
C18H34O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
298.25079
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU021951
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU021952
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU021953
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU021954
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU021955
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU021956
(E)-Hexadec-9-enoic acid
6 spectra
C16H30O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
254.22459
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU090051
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU090052
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU090053
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU090054
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU090055
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU090056
(Z)-Hexadec-9-enoic acid
12 spectra
C16H30O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
254.22459
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU105251
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU138251
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU105252
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU138252
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU105253
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU138253
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU105254
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU138254
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU105255
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU138255
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU105256
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU138256
1,1,2-Trimethyl-1H-benzo[e]indole
6 spectra
C15H15N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
209.12041
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU059801
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU059802
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU059803
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU059804
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU059805
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU059806
1,1,3-Trimethyl-2-thiourea
6 spectra
C4H10N2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
118.05650
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU088601
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU088602
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU088603
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU088604
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU088605
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU088606
1,10-Phenanthroline
12 spectra
C12H8N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
180.06870
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU017601
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU100801
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU017602
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU100802
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU017603
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU100803
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU017604
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU100804
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU017605
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU100805
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU017606
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU100806
1,1`-Disulfanediyldiazepan-2-one
6 spectra
C12H20N2O2S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
288.09659
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU050301
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU050302
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU050303
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU050304
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU050305
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU050306
1,2,3-Benzotriazole
12 spectra
C6H5N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
119.04830
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU063401
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU063451
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU063402
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU063452
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU063403
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU063453
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU063404
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU063454
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU063405
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU063455
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU063406
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU063456
1,2,3-Triazole
1 spectrum
C2H3N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
69.03270
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
SM800003
1,2-Benzisothiazolin-3-one
8 spectra
C7H5NOS
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
151.00920
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU033001
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU033051
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU033052
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU033053
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU033054
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU033005
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU033055
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU033006
1,2-Dimethyl-5-nitroimidazole
6 spectra
C5H7N3O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
141.05380
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU060701
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU060702
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU060703
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU060704
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU060705
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU060706
1,2-Diphenylethanone
6 spectra
C14H12O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.08881
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU100901
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU100902
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU100903
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU100904
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU100905
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU100906
1,3-Benzenedicarboxylic acid
6 spectra
C8H6O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.02660
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU084351
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU084352
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU084353
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU084354
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU084355
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU084356
1,3-Dihydroxyanthraquinone
1 spectrum
C14H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
240.04227
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
SM827751
1,3-Dimethylpteridine-2,4-dione
6 spectra
C8H8N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
192.06473
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
EQ310401
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
EQ310402
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
EQ310403
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
EQ310404
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
EQ310405
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
EQ310406
1,3-Diphenylguanidine
12 spectra
C13H13N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
211.11090
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU084501
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU084551
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU084502
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU084552
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU084503
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU084553
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU084504
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU084554
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU084505
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU084555
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU084506
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU084556
1,3-Dipropan-2-ylurea
6 spectra
C7H16N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
144.12630
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU036001
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU036002
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU036003
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU036004
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU036005
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU036006
1,4-Bis(N-isopropylamino)anthraquinone
3 spectra
C20H22N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
322.16809
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU052903
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU052904
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU052905
1,4-Diaminoanthraquinone
11 spectra
C14H10N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.07420
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU053001
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
LU053051
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU053002
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
LU053052
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU053003
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
LU053053
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU053004
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
LU053054
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU053005
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
LU053055
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
LU053056
1,5-Naphthalenediamine
6 spectra
C10H10N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
158.08440
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU054301
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU054302
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU054303
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
LU054304
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU054305
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU054306
1-(2,6-Dichlorophenyl)-2-indolinone
5 spectra
C14H9Cl2NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
277.00610
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
LU115001
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
LU115002
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
LU115003
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
LU115005
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
LU115006
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