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LC-ESI-QQ
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9,615 Hit.
( 1,214 - 1,347 Displayed )
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Name
Formula / Structure
ExactMass
ID
3-Indolylcarboxylic Acid, 3-Indoleformic Acid, Ind...
5 spectra
C9H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
161.16000
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS109101
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS109102
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS109107
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS109108
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS109109
3-Indoxyl sulfate
5 spectra
C8H7NO4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
213.00958
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001246
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001247
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001248
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001249
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001250
3-Iodotyrosine
10 spectra
C9H10INO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
306.97055
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003227
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001241
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003228
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001242
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003229
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001243
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003230
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001244
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003231
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001245
3-Man2GlcNAc
6 spectra
C20H35NO16
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
545.19556
LC-ESI-QQ; MS2; CE:15V; Amide
MSBNK-Fukuyama_Univ-FU000001
LC-ESI-QQ; MS2; CE:15V; ODS
MSBNK-Fukuyama_Univ-FU000004
LC-ESI-QQ; MS2; CE:20V; Amide
MSBNK-Fukuyama_Univ-FU000002
LC-ESI-QQ; MS2; CE:20V; ODS
MSBNK-Fukuyama_Univ-FU000005
LC-ESI-QQ; MS2; CE:25V; Amide
MSBNK-Fukuyama_Univ-FU000003
LC-ESI-QQ; MS2; CE:25V; ODS
MSBNK-Fukuyama_Univ-FU000006
3-Man3GlcNAc
6 spectra
C26H45NO21
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
707.24841
LC-ESI-QQ; MS2; CE:15V; Amide
MSBNK-Fukuyama_Univ-FU000013
LC-ESI-QQ; MS2; CE:15V; ODS
MSBNK-Fukuyama_Univ-FU000016
LC-ESI-QQ; MS2; CE:20V; Amide
MSBNK-Fukuyama_Univ-FU000014
LC-ESI-QQ; MS2; CE:20V; ODS
MSBNK-Fukuyama_Univ-FU000017
LC-ESI-QQ; MS2; CE:25V; Amide
MSBNK-Fukuyama_Univ-FU000015
LC-ESI-QQ; MS2; CE:25V; ODS
MSBNK-Fukuyama_Univ-FU000018
3-Man4GlcNAc
6 spectra
C32H55NO26
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
869.30121
LC-ESI-QQ; MS2; CE:25V; Amide
MSBNK-Fukuyama_Univ-FU000025
LC-ESI-QQ; MS2; CE:25V; ODS
MSBNK-Fukuyama_Univ-FU000028
LC-ESI-QQ; MS2; CE:30V; Amide
MSBNK-Fukuyama_Univ-FU000026
LC-ESI-QQ; MS2; CE:30V; ODS
MSBNK-Fukuyama_Univ-FU000029
LC-ESI-QQ; MS2; CE:35V; Amide
MSBNK-Fukuyama_Univ-FU000027
LC-ESI-QQ; MS2; CE:35V; ODS
MSBNK-Fukuyama_Univ-FU000030
3-Mercapto-D-valine, Cupripen, beta-Thiovaline, (2...
1 spectrum
C5H11NO2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
149.21300
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS019601
3-Methyl-2-oxobutyric acid, 3-Methyl-2-oxobutyric ...
1 spectrum
C5H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
116.11600
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS068607
3-Methyl-L-histidine, N-pros-Methyl-L-histidine, 3...
6 spectra
C7H11N3O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
169.18401
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS096701
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS096702
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS096703
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS096704
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS096705
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS096707
3-Methyladenine
5 spectra
C6H7N5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
149.07014
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003367
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003368
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003369
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003370
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003371
3-Methyladenine, 6-Amino-3-methylpurine
3 spectra
C6H7N5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
149.15700
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS010601
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS010602
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS010603
3-Methylbenzoic acid
4 spectra
C8H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
136.05243
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001352
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001353
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001354
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001355
3-Methylguanine
10 spectra
C6H7N5O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
165.06506
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003407
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001389
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003408
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001390
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003409
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001391
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003410
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001392
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003411
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001393
3-Methylsulfinylpropyl glucosinolate, beta-D-Gluco...
11 spectra
C11H21NO10S3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
423.48099
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107401
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107402
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107403
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107404
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107405
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107407
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107408
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107409
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107410
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107411
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS107412
3-Methylxanthine, 2,6-Dihydroxy-3-methylpurine, 3-...
4 spectra
C6H6N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
166.14000
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS103101
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS103102
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS103103
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS103105
3-O-Feruloylquinic acid
1 spectrum
C17H20O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
368.33801
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000307
3-Phenylpropionic acid
4 spectra
C9H10O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
150.06808
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001706
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001707
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001708
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001709
3-Phosphoglycerate
4 spectra
C3H7O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
185.99294
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003686
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003687
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003688
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003689
3-Pyridinol, 3-Pyridyl alcohol, 3-Oxopyridine, 3-P...
5 spectra
C5H5NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
95.10100
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS076401
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS076402
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS076403
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS076404
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS076405
33FTA
7 spectra
C6H5F7O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
242.01778
LC-ESI-QQ; MS
MSBNK-PFOS_research_group-FFF00372
LC-ESI-QQ; MS2; CE10; [M-H]-
MSBNK-PFOS_research_group-FFF00373
LC-ESI-QQ; MS2; CE20; [M-H]-
MSBNK-PFOS_research_group-FFF00374
LC-ESI-QQ; MS2; CE30; [M-H]-
MSBNK-PFOS_research_group-FFF00375
LC-ESI-QQ; MS2; CE40; [M-H]-
MSBNK-PFOS_research_group-FFF00376
LC-ESI-QQ; MS2; CE50; [M-H]-
MSBNK-PFOS_research_group-FFF00377
LC-ESI-QQ; MS2; CE60; [M-H]-
MSBNK-PFOS_research_group-FFF00378
3alpha,12alpha-Dihydroxy-5beta-cholanate, Deoxycho...
7 spectra
C24H40O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
392.57999
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124001
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124002
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124007
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124008
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124009
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124010
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124011
3alpha,7alpha,12alpha-Trihydroxy-5beta-cholan-24-o...
9 spectra
C24H40O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
408.57901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS066801
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS066802
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS066803
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS066804
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS066807
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS066808
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS066809
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS066810
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS066811
3mPFOA
4 spectra
C8HF15O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
413.97369
LC-ESI-QQ; MS2; CE10eV
MSBNK-PFOS_research_group-FFF00362
LC-ESI-QQ; MS2; CE20eV
MSBNK-PFOS_research_group-FFF00363
LC-ESI-QQ; MS2; CE30eV
MSBNK-PFOS_research_group-FFF00364
LC-ESI-QQ; MS2; CE40eV
MSBNK-PFOS_research_group-FFF00365
3mPFOS
6 spectra
C8HF17O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
499.93750
LC-ESI-QQ; MS2; CE10eV
MSBNK-PFOS_research_group-FFF00317
LC-ESI-QQ; MS2; CE20eV
MSBNK-PFOS_research_group-FFF00318
LC-ESI-QQ; MS2; CE30eV
MSBNK-PFOS_research_group-FFF00319
LC-ESI-QQ; MS2; CE40eV
MSBNK-PFOS_research_group-FFF00321
LC-ESI-QQ; MS2; CE50eV
MSBNK-PFOS_research_group-FFF00322
LC-ESI-QQ; MS2; CE60eV
MSBNK-PFOS_research_group-FFF00323
4',5,7-trihydroxyisoflavone, 5,7-Dihydroxy-3-(4-hy...
4 spectra
C15H10O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
270.23999
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS040001
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS040002
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS040003
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS040004
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