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96,350 Hit.
( 2,610 - 2,749 Displayed )
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Name
Formula / Structure
ExactMass
ID
1-Hexanamine, 1-Aminohexane, Hexylamine
6 spectra
C6H15N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
101.19300
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS008901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS008902
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS008903
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS008904
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS008905
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS008906
1-Hexanoic acid
5 spectra
C6H12O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
116.08373
LC-ESI-IT; MS2; m/z: 115.2; [M-H]-
MSBNK-Metabolon-MT000145
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000426
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000427
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000428
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000429
1-Hexyl-3-methylimidazolium
10 spectra
[C10H19N2]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
167.15430
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111012899
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111012896
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111012897
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111012890
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111012898
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111012891
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111012894
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111012895
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111012893
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111012892
1-Hydroxy-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glyce...
1 spectrum
C26H50NO7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
519.33252
LC-ESI-QTOF; MS2; CE:39 eV; [M-H]-
MSBNK-BS-BS001054
1-Hydroxy-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glyce...
1 spectrum
C26H48NO7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
517.31677
LC-ESI-QTOF; MS2; CE:39 eV; [M-H]-
MSBNK-BS-BS001060
1-Hydroxy-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glyce...
1 spectrum
C23H42NO7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
475.26999
LC-ESI-QTOF; MS2; CE:36 eV; [M-H]-
MSBNK-BS-BS001052
1-Hydroxy-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-...
1 spectrum
C23H44NO7P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
477.28601
LC-ESI-QTOF; MS2; CE:36 eV; [M-H]-
MSBNK-BS-BS001050
1-Hydroxy-2-methoxyanthraquinone
4 spectra
C15H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
254.24460
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02271
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02270
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02269
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02272
1-Hydroxy-2-naphthoate
3 spectra
C11H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
188.04730
LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N100527_9CB7
LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N100526_B8BB
LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M-H]-
MSBNK-Antwerp_Univ-METOX_N100526_9C9C
1-Hydroxy-Benzotriazol
7 spectra
C6H5N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
135.04326
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU223201
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU223202
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU223203
LC-ESI-QTOF; MS2; HILIC; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU223207
LC-ESI-QTOF; MS2; HILIC; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU223208
LC-ESI-QTOF; MS2; HILIC; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU223209
LC-ESI-QTOF; MS2; HILIC; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU223210
1-Hydroxyanthraquinone
5 spectra
C14H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.04730
APCI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA002503
APCI-ITFT; MS2; CE: 35%; R=30000; [M]-
MSBNK-UFZ-UA002505
ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA002501
ESI-ITFT; MS2; CE: 35%; R=30000; [M-H]-
MSBNK-UFZ-UA002502
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM828451
1-Hydroxybenzotriazol
26 spectra
C6H5N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
135.04330
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111010186
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111010900
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111010176
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111010180
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111010177
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111010902
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111010175
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111010182
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111010183
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111010173
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111010903
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111010172
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111010909
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111010179
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111010185
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111010905
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111010906
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111010184
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111010907
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111010181
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111010908
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111010178
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111010904
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111010174
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111010901
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111010187
1-Hydroxybenzotriazole
22 spectra
C6H5N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
135.04326
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002228
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002226
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT002227
LC-ESI-ITFT; MS2; 80-110; R=7500; [M+H]+
MSBNK-Eawag_Additional_Specs-ETS00117
LC-ESI-QFT; MS2; CE: 120; R=35000; [M+H]+
MSBNK-Eawag-EQ289907
LC-ESI-QFT; MS2; CE: 120; R=35000; [M-H]-
MSBNK-Eawag-EQ289957
LC-ESI-QFT; MS2; CE: 150; R=35000; [M+H]+
MSBNK-Eawag-EQ289908
LC-ESI-QFT; MS2; CE: 150; R=35000; [M-H]-
MSBNK-Eawag-EQ289958
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
MSBNK-Eawag-EQ289901
LC-ESI-QFT; MS2; CE: 15; R=35000; [M-H]-
MSBNK-Eawag-EQ289951
LC-ESI-QFT; MS2; CE: 180; R=35000; [M+H]+
MSBNK-Eawag-EQ289909
LC-ESI-QFT; MS2; CE: 180; R=35000; [M-H]-
MSBNK-Eawag-EQ289959
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
MSBNK-Eawag-EQ289902
LC-ESI-QFT; MS2; CE: 30; R=35000; [M-H]-
MSBNK-Eawag-EQ289952
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
MSBNK-Eawag-EQ289903
LC-ESI-QFT; MS2; CE: 45; R=35000; [M-H]-
MSBNK-Eawag-EQ289953
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
MSBNK-Eawag-EQ289904
LC-ESI-QFT; MS2; CE: 60; R=35000; [M-H]-
MSBNK-Eawag-EQ289954
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
MSBNK-Eawag-EQ289905
LC-ESI-QFT; MS2; CE: 75; R=35000; [M-H]-
MSBNK-Eawag-EQ289955
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
MSBNK-Eawag-EQ289906
LC-ESI-QFT; MS2; CE: 90; R=35000; [M-H]-
MSBNK-Eawag-EQ289956
1-Hydroxyethane-1,1-diphosphonic Acid, 1-Hydroxyet...
4 spectra
C2H8O7P2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
206.03101
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS022801
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS022802
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS022803
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS022807
1-Hydroxyethanecarboxylic acid, alpha-Hydroxypropa...
1 spectrum
C3H6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
90.07800
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT207820
1-Hydroxyethanecarboxylic acid, alpha-Hydroxypropa...
1 spectrum
C3H6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
90.07800
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS078202
1-Hydroxyphenanzine
3 spectra
C12H8N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.06366
LC-ESI-QTOF; MS2; CE: 10; R=; [M+H]+
MSBNK-BGC_Munich-RP018601
LC-ESI-QTOF; MS2; CE: 20; R=; [M+H]+
MSBNK-BGC_Munich-RP018602
LC-ESI-QTOF; MS2; CE: 40; R=; [M+H]+
MSBNK-BGC_Munich-RP018603
1-Hydroxypyrene
9 spectra
C16H10O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
218.07317
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002429
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002428
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002430
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU050051
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU050052
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU050053
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU050054
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU050055
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU050056
1-hydroxypyrene
3 spectra
C16H10O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
218.07320
APCI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA004403
ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-UFZ-UA004401
ESI-ITFT; MS2; CE: 35%; R=30000; [M-H]-
MSBNK-UFZ-UA004402
1-Isopropyl-5-methyl-1H-indole-2,3-dione
2 spectra
C12H13NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
203.09500
LC-APCI-ITFT; MS2; CE:120 HCD;
MSBNK-CASMI_2012-SMI00152
LC-APCI-ITFT; MS2; CE:90 HCD;
MSBNK-CASMI_2012-SMI00151
1-Isothiocyanato-4-(methylsulfinyl)-butane
21 spectra
C6H11NOS2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
177.28999
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303471
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303472
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303473
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303474
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303475
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303476
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303477
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303478
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303479
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303480
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303481
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303482
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307216
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307218
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307221
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307223
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307226
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307228
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307230
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR309430
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310456
1-Isothiocyanato-6-(methylsulfinyl)-hexane
1 spectrum
C8H15NOS2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
205.05951
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+
MSBNK-RIKEN-PR101036
1-Isothiocyanato-6-(methylsulfonyl)-hexane
1 spectrum
C8H15NO2S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
221.05441
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+
MSBNK-RIKEN-PR101039
1-Isothiocyanato-7-(methylsulfinyl)-heptane
1 spectrum
C9H17NOS2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
219.07516
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+
MSBNK-RIKEN-PR101035
1-isothiocyanato-7-methanesulfinylheptane
1 spectrum
C9H17NOS2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
219.37100
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310895
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