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96,350 Hit.
( 2,868 - 3,030 Displayed )
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Name
Formula / Structure
ExactMass
ID
1-Methylhydantoin
5 spectra
C4H6N2O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
114.04293
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001343
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001344
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001345
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001346
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001347
1-Methylimidazole
3 spectra
C4H6N2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
82.05310
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002331
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002332
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002333
1-Methylnicotinamide
7 spectra
[C7H9N2O]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
137.07149
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003442
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003443
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003444
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003445
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003446
LC-ESI-QTOF; MS2; CE:30 V; [M]+
MSBNK-RIKEN-PR100412
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M]+
MSBNK-RIKEN-PR100411
1-Methylsulfinylbutenyl isothiocyante
25 spectra
C6H9NOS2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
175.27400
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303459
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303460
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303461
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303462
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303463
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303464
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303465
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303466
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303467
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303468
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303469
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303470
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307173
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307177
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307181
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307185
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307188
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307192
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307196
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307200
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307204
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307208
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307212
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308766
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310458
1-Myristoyl-2-hydroxy-sn-glycero-3-phosphate
1 spectrum
C17H35O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
382.21204
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100784
1-Myristoyl-2-Hydroxy-sn-Glycero-3-Phosphoethanola...
11 spectra
C19H40NO7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
425.50500
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081501
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081502
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081503
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081504
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081505
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081506
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081507
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081508
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081509
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081510
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081511
1-Myristoyl-sn-glycero-3-phosphocholine
32 spectra
C22H46NO7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
467.30121
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111015058
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111015391
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111015049
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111015400
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111015045
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111015392
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111015050
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111015404
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111015054
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111015396
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111015057
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111015405
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111015048
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111015398
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111015046
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111015403
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111015055
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111015402
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111015043
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111015051
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111015394
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111015399
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111015052
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111015397
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111015056
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111015401
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111015044
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111015395
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111015053
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111015406
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111015047
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111015393
1-Myristoyllysophosphatidic acid, 14:0 LysoPA, 1-t...
9 spectra
C17H35O7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
382.43600
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS080901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS080904
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS080905
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS080907
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS080908
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS080909
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS080910
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS080911
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS080912
1-N-Methyl-5-thiotetrazole
3 spectra
C2H4N4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
116.01566
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002416
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002414
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002415
1-Naphthaleneacetic acid
4 spectra
C12H10O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
186.06808
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Waters-WA000168
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Waters-WA000169
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Waters-WA000170
LC-ESI-QQ; MS2; CE:5 V; [M-H]-
MSBNK-Waters-WA000167
1-naphthalenecarboxaldehyde, 2-hydroxy
2 spectra
C11H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
172.05240
APCI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA001303
APCI-ITFT; MS2; CE: 35%; R=30000; [M-H]-
MSBNK-UFZ-UA001304
1-naphthalenesulfonate
6 spectra
C10H8O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
208.01939
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU075551
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU075552
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU075553
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU075554
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU075555
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU075556
1-Naphthalenesulfonic acid
2 spectra
C10H8O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
208.01939
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000016
LC-ESI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000213
1-Naphthoic acid methyl ester
1 spectrum
C12H10O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
186.06808
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM803101
1-Naphthol
10 spectra
C10H8O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
144.05750
APCI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA004603
APCI-ITFT; MS2; CE: 35%; R=30000; [M-H]-
MSBNK-UFZ-UA004604
ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA004601
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000017
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU113601
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU113602
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU113603
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU113604
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU113605
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU113606
1-Naphthol-5-sulfonic acid
1 spectrum
C10H8O4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.01433
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM833051
1-Naphthylamine
13 spectra
C10H9N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
143.07350
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT000731
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT000730
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT000732
LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
MSBNK-UFZ-WANA132101AD6CPH
LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
MSBNK-UFZ-WANA132103B085PH
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-UFZ-WANA132105070APH
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-UFZ-WANA132111C9CFPH
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-UFZ-WANA132113D9F1PH
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-UFZ-WANA1321155BE0PH
LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
MSBNK-UFZ-WANA1321213166PH
LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
MSBNK-UFZ-WANA1321237762PH
LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
MSBNK-UFZ-WANA132125AF82PH
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM800201
1-Naphthylsulfonic acid
3 spectra
C10H8O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
208.01941
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000880
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000881
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000882
1-nitropyrene
2 spectra
C16H9NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
247.06329
APCI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA003403
APCI-ITFT; MS2; CE: 35%; R=30000; [M]-
MSBNK-UFZ-UA003405
1-O-beta-D-Glucopyranosyl sinapate
2 spectra
C17H22O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
386.12131
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+
MSBNK-RIKEN-PR101056
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR101004
1-O-Caffeoylquinic acid
1 spectrum
C16H18O9
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
354.31100
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PM000304
1-O-hexadecyl-2-C-methyl-3-phosphatidylcholine
1 spectrum
C25H54NO6P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
495.36887
LC-ESI-ITFT; MS2; HCD; CE 30 eV; [M+H]+
MSBNK-MPI_for_Chemical_Ecology-CE000694
1-O-Hexyl-2,3,5-trimethylhydroquinone
3 spectra
C15H24O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
236.17763
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000710
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000711
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000709
1-O-Sinapoyl-beta-D-glucose, 1-O-b-D-glucopyranosy...
11 spectra
C17H22O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
386.35300
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118101
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118102
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118103
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118104
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118105
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118106
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118107
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118108
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118109
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118110
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS118111
1-octadecanoyl-rac-glycerol
5 spectra
C21H42O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
358.30829
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N106432_3B51
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M+Na]+
MSBNK-Antwerp_Univ-METOX_N106418_9EE2
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N106432_D0B8
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M+CH3COO]-
MSBNK-Antwerp_Univ-METOX_N106431_187B
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M+Na]+
MSBNK-Antwerp_Univ-METOX_N106418_2347
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