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LC-ESI-IT
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664 Hit.
( 1 - 40 Displayed )
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Name
Formula / Structure
ExactMass
ID
(+-)-Baclofen
5 spectra
C10H12ClNO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
213.05566
LC-ESI-IT; MS2; m/z: 214; [M+H]+
MSBNK-Keio_Univ-KO008869
LC-ESI-IT; MS3; m/z: 214/141; [M+H]+
MSBNK-Keio_Univ-KO008873
LC-ESI-IT; MS3; m/z: 214/151; [M+H]+
MSBNK-Keio_Univ-KO008872
LC-ESI-IT; MS3; m/z: 214/158; [M+H]+
MSBNK-Keio_Univ-KO008871
LC-ESI-IT; MS3; m/z: 214/179; [M+H]+
MSBNK-Keio_Univ-KO008870
(des-arg9)-Bradykinin
1 spectrum
C44H61N11O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
903.46027
LC-ESI-IT; MS2; m/z: 453.0; [M+2H]2+
MSBNK-Metabolon-MT000132
1,5-Anhydroglucitol
1 spectrum
C6H12O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
164.06847
LC-ESI-IT; MS2; m/z: 163.2; [M-H]-
MSBNK-Metabolon-MT000011
1,5-Diphenylcarbohydrazide
3 spectra
C13H14N4O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
242.11676
LC-ESI-IT; MS2; m/z: 243; [M+H]+
MSBNK-Keio_Univ-KO009100
LC-ESI-IT; MS3; m/z: 243/150; [M+H]+
MSBNK-Keio_Univ-KO009102
LC-ESI-IT; MS3; m/z: 243/226; [M+H]+
MSBNK-Keio_Univ-KO009101
1-Hexanoic acid
1 spectrum
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
1-Linoleoylglycerol
1 spectrum
C21H38O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
354.27701
LC-ESI-IT; MS2; m/z: 279.2; [M-C3H7O2]-
MSBNK-Metabolon-MT000148
1-Methyladenosine
3 spectra
C11H15N5O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
281.11240
LC-ESI-IT; MS2; m/z: 282.1; [M+H]+
MSBNK-Metabolon-MT000077
LC-ESI-IT; MS2; m/z: 282; [M+H]+
MSBNK-Keio_Univ-KO009121
LC-ESI-IT; MS3; m/z: 282/150; [M+H]+
MSBNK-Keio_Univ-KO009122
1-Oleoylglycerophosphocholine
1 spectrum
[C26H53NO7P]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
522.35596
LC-ESI-IT; MS2; m/z: 522.4; [M]+
MSBNK-Metabolon-MT000088
1-Palmitoylglycerophosphocholine
1 spectrum
[C24H51NO7P]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
496.34030
LC-ESI-IT; MS2; m/z: 496.4; [M]+
MSBNK-Metabolon-MT000099
1-Stearoylglycerophosphocholine
1 spectrum
[C26H55NO7P]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
524.37158
LC-ESI-IT; MS2; m/z: 524.4; [M]+
MSBNK-Metabolon-MT000126
10-Heptadecenoic acid (17:1(n-7))
1 spectrum
C17H32O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
268.24023
LC-ESI-IT; MS2; m/z: 267.3; [M-H]-
MSBNK-Metabolon-MT000118
10-Nonadecenoic acid (19:1(n-9))
1 spectrum
C19H36O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
296.27151
LC-ESI-IT; MS2; m/z: 295.4; [M-H]-
MSBNK-Metabolon-MT000050
10c-Undecenoic acid
1 spectrum
C11H20O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
184.14633
LC-ESI-IT; MS2; m/z: 183.3; [M-H]-
MSBNK-Metabolon-MT000097
2'-Deoxyadenosine
1 spectrum
C10H13N5O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
251.10184
LC-ESI-IT; MS2; m/z: 252; [M+H]+
MSBNK-Keio_Univ-KO008947
2'-Deoxycytidine
2 spectra
C9H13N3O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
227.09061
LC-ESI-IT; MS2; m/z: 228; [M+H]+
MSBNK-Keio_Univ-KO008940
LC-ESI-IT; MS3; m/z: 228/112; [M+H]+
MSBNK-Keio_Univ-KO008941
2'-Deoxyguanosine
2 spectra
C10H13N5O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
267.09674
LC-ESI-IT; MS2; m/z: 268; [M+H]+
MSBNK-Keio_Univ-KO008942
LC-ESI-IT; MS3; m/z: 268/152; [M+H]+
MSBNK-Keio_Univ-KO008943
2-Aminobutyric acid
1 spectrum
C4H9NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
103.06333
LC-ESI-IT; MS2; m/z: 104.1; [M+H]+
MSBNK-Metabolon-MT000144
2-Arachidonoyl glycerol
1 spectrum
C23H38O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
378.27701
LC-ESI-IT; MS2; m/z: 377.1; [M-H]-
MSBNK-Metabolon-MT000017
2-Hydroxyhippuric acid
1 spectrum
C9H9NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
195.05316
LC-ESI-IT; MS2; m/z: 194.1; [M-H]-
MSBNK-Metabolon-MT000074
2-Hydroxyoctanoic acid
1 spectrum
C8H16O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
160.10994
LC-ESI-IT; MS2; m/z: 159.2; [M-H]-
MSBNK-Metabolon-MT000051
2-Linoleoyl-glycerol
1 spectrum
C21H38O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
354.27701
LC-ESI-IT; MS2; m/z: 279.3; [M-C3H7O2]-
MSBNK-Metabolon-MT000001
3-Carboxy-4-methyl-5-propyl-2-furanpropanoic acid
1 spectrum
C12H16O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
240.09978
LC-ESI-IT; MS2; m/z: 239.1; [M-H]-
MSBNK-Metabolon-MT000094
3-Hydroxy-DL-kynurenine
6 spectra
C10H12N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.07971
LC-ESI-IT; MS2; m/z: 225; [M+H]+
MSBNK-Keio_Univ-KO009000
LC-ESI-IT; MS3; m/z: 225/208; [M+H]+
MSBNK-Keio_Univ-KO009001
LC-ESI-IT; MS4; m/z: 225/208/162; [M+H]+
MSBNK-Keio_Univ-KO009005
LC-ESI-IT; MS4; m/z: 225/208/166; [M+H]+
MSBNK-Keio_Univ-KO009004
LC-ESI-IT; MS4; m/z: 225/208/180; [M+H]+
MSBNK-Keio_Univ-KO009003
LC-ESI-IT; MS4; m/z: 225/208/190; [M+H]+
MSBNK-Keio_Univ-KO009002
3-Hydroxydecanoic acid
1 spectrum
C10H20O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
188.14124
LC-ESI-IT; MS2; m/z: 187.2; [M-H]-
MSBNK-Metabolon-MT000041
3-Indolepropionic acid
1 spectrum
C11H11NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
189.07898
LC-ESI-IT; MS2; m/z: 190.1; [M+H]+
MSBNK-Metabolon-MT000130
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