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MS4
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70 Hit.
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Name
Formula / Structure
ExactMass
ID
3-Hydroxy-DL-kynurenine
4 spectra
C10H12N2O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.07971
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-Iodotyrosine
5 spectra
C9H10INO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
306.97055
LC-ESI-IT; MS4; m/z: 308/262/135; [M+H]+
MSBNK-Keio_Univ-KO009013
LC-ESI-IT; MS4; m/z: 308/291/164; [M+H]+
MSBNK-Keio_Univ-KO009012
LC-ESI-IT; MS4; m/z: 308/291/245; [M+H]+
MSBNK-Keio_Univ-KO009011
LC-ESI-IT; MS4; m/z: 308/291/249; [M+H]+
MSBNK-Keio_Univ-KO009010
LC-ESI-IT; MS4; m/z: 308/291/273; [M+H]+
MSBNK-Keio_Univ-KO009009
Adenylosuccinic acid
3 spectra
C14H18N5O11P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
463.07404
LC-ESI-IT; MS4; m/z: 464/252/192; [M+H]+
MSBNK-Keio_Univ-KO008843
LC-ESI-IT; MS4; m/z: 464/252/206; [M+H]+
MSBNK-Keio_Univ-KO008842
LC-ESI-IT; MS4; m/z: 464/252/234; [M+H]+
MSBNK-Keio_Univ-KO008841
Albendazole
1 spectrum
C12H15N3O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
265.08850
LC-ESI-IT; MS4; m/z: 266/234/192; [M+H]+
MSBNK-Keio_Univ-KO008868
Allocryptopine
3 spectra
C21H23NO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
369.15762
LC-ESI-IT; MS4; m/z: 370/290/232; [M+H]+
MSBNK-Keio_Univ-KO008818
LC-ESI-IT; MS4; m/z: 370/290/260; [M+H]+
MSBNK-Keio_Univ-KO008817
LC-ESI-IT; MS4; m/z: 370/290/275; [M+H]+
MSBNK-Keio_Univ-KO008816
Amidopyrine
1 spectrum
C13H17N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
231.13716
LC-ESI-IT; MS4; m/z: 232/187/159; [M+H]+
MSBNK-Keio_Univ-KO008859
Biotin
2 spectra
C10H16N2O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
244.08817
LC-ESI-IT; MS4; m/z: 245/227/166; [M+H]+
MSBNK-Keio_Univ-KO008885
LC-ESI-IT; MS4; m/z: 245/227/209; [M+H]+
MSBNK-Keio_Univ-KO008884
Blasticidin S
3 spectra
C17H26N8O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
422.20261
LC-ESI-IT; MS4; m/z: 423/312/154; [M+H]+
MSBNK-Keio_Univ-KO008881
LC-ESI-IT; MS4; m/z: 423/312/171; [M+H]+
MSBNK-Keio_Univ-KO008880
LC-ESI-IT; MS4; m/z: 423/312/222; [M+H]+
MSBNK-Keio_Univ-KO008879
Bumetanide
1 spectrum
C17H20N2O5S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
364.10928
LC-ESI-IT; MS4; m/z: 365/348/292; [M+H]+
MSBNK-Keio_Univ-KO009099
Chloramphenicol
1 spectrum
C11H12Cl2N2O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
322.01233
LC-ESI-IT; MS4; m/z: 323/305/241; [M+H]+
MSBNK-Keio_Univ-KO008921
Ciprofloxacin
1 spectrum
C17H18FN3O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
331.13321
LC-ESI-IT; MS4; m/z: 332/288/268; [M+H]+
MSBNK-Keio_Univ-KO008907
D-(+)-Pantothenic acid
2 spectra
C9H17NO5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
219.11067
LC-ESI-IT; MS4; m/z: 220/184/142; [M+H]+
MSBNK-Keio_Univ-KO009185
LC-ESI-IT; MS4; m/z: 220/184/166; [M+H]+
MSBNK-Keio_Univ-KO009186
DAMGO
1 spectrum
C26H35N5O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
513.25873
LC-ESI-IT; MS4; m/z: 514/453/290; [M+H]+
MSBNK-Keio_Univ-KO008838
Desthiobiotin
2 spectra
C10H18N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
214.13174
LC-ESI-IT; MS4; m/z: 215/197/136; [M+H]+
MSBNK-Keio_Univ-KO009106
LC-ESI-IT; MS4; m/z: 215/197/179; [M+H]+
MSBNK-Keio_Univ-KO009105
Kynurenine
3 spectra
C10H12N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
208.08479
LC-ESI-IT; MS4; m/z: 209/192/150; [M+H]+
MSBNK-Keio_Univ-KO009020
LC-ESI-IT; MS4; m/z: 209/192/164; [M+H]+
MSBNK-Keio_Univ-KO009019
LC-ESI-IT; MS4; m/z: 209/192/174; [M+H]+
MSBNK-Keio_Univ-KO009018
L-Anserine
1 spectrum
C10H16N4O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
240.12224
LC-ESI-IT; MS4; m/z: 241/224/180; [M+H]+
MSBNK-Keio_Univ-KO008823
L-Homocarnosine
1 spectrum
C10H16N4O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
240.12224
LC-ESI-IT; MS4; m/z: 241/156/110; [M+H]+
MSBNK-Keio_Univ-KO008993
Minocycline
3 spectra
C23H27N3O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
457.18491
LC-ESI-IT; MS4; m/z: 458/441/283; [M+H]+
MSBNK-Keio_Univ-KO009055
LC-ESI-IT; MS4; m/z: 458/441/337; [M+H]+
MSBNK-Keio_Univ-KO009054
LC-ESI-IT; MS4; m/z: 458/441/352; [M+H]+
MSBNK-Keio_Univ-KO009053
N-Acetylphenylalanine
1 spectrum
C11H13NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
207.08954
LC-ESI-IT; MS4; m/z: 208/162/120; [M+H]+
MSBNK-Keio_Univ-KO008855
N1-Acetylspermine
2 spectra
C12H28N4O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
244.22630
LC-ESI-IT; MS4; m/z: 245/129/112; [M+H]+
MSBNK-Keio_Univ-KO008811
LC-ESI-IT; MS4; m/z: 245/171/100; [M+H]+
MSBNK-Keio_Univ-KO008810
Na-Benzenolarginine ethylester
1 spectrum
C15H22N4O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
306.16919
LC-ESI-IT; MS4; m/z: 307/247/144; [M+H]+
MSBNK-Keio_Univ-KO008893
Neostigmine
2 spectra
[C12H19N2O2]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
223.14465
LC-ESI-IT; MS4; m/z: 223/208/135; [M+H]+
MSBNK-Keio_Univ-KO009129
LC-ESI-IT; MS4; m/z: 223/208/164; [M+H]+
MSBNK-Keio_Univ-KO009128
Pendimethalin
2 spectra
C13H19N3O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
281.13757
LC-ESI-IT; MS4; m/z: 282/212/118; [M+H]+
MSBNK-Keio_Univ-KO009160
LC-ESI-IT; MS4; m/z: 282/212/194; [M+H]+
MSBNK-Keio_Univ-KO009159
Pentamidine
1 spectrum
C19H24N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
340.18994
LC-ESI-IT; MS4; m/z: 341/324/188; [M+H]+
MSBNK-Keio_Univ-KO009181
Pirimicarb
2 spectra
C11H18N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.14297
LC-ESI-IT; MS4; m/z: 239/182/137; [M+H]+
MSBNK-Keio_Univ-KO009156
LC-ESI-IT; MS4; m/z: 239/195/150; [M+H]+
MSBNK-Keio_Univ-KO009155
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