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LC-ESI-QQ
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9,615 Hit.
( 8,459 - 8,576 Displayed )
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Name
Formula / Structure
ExactMass
ID
S-Lactoylglutathione
10 spectra
C13H21N3O8S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
379.10495
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003297
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001290
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003298
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001291
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003299
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001292
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003300
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001293
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003301
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001294
S-Pyruvoylglutathione, S-Lactoylglutathione, S-Pyr...
5 spectra
C13H21N3O8S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
379.38901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS068301
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS068302
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS068303
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS068305
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS068306
S-Sulforaphene, (-)4-Isothiocyanato-4R-(methylsulf...
2 spectra
C6H9NOS2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
175.27400
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS106901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS106902
Saccharolactic acid, mucic acid, Tetrahydroxyhexan...
2 spectra
C6H10O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
210.13800
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS104401
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS104407
Sakuranetin
5 spectra
C16H14O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
286.28299
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086601
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086602
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086603
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086604
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086605
Salicylic acid
5 spectra
C7H6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
138.03169
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001003
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001004
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001005
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001006
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001007
Salsolinol
2 spectra
C10H13NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
179.09464
LC-ESI-QQ; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB002163
LC-ESI-QQ; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB002164
Sanguinarine
7 spectra
[C20H14NO4]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
332.09229
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO004022
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO004023
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO004024
LC-ESI-QQ; MS2; CE:35 eV; M+
MSBNK-IPB_Halle-PB002201
LC-ESI-QQ; MS2; CE:40 eV; M+
MSBNK-IPB_Halle-PB002202
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO004025
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO004026
Saponarin, Isovitexin-7-O-beta-D-glucopyranoside, ...
4 spectra
C27H30O15
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
594.52197
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086701
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086702
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086704
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086706
Sarcosine
8 spectra
C3H7NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
89.04768
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003987
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001799
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003988
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001800
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003989
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001801
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003990
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003991
Sarsasapogenin, (25S)-5beta-Spirostan-3beta-ol, (3...
4 spectra
C27H44O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
416.64600
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS089401
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS089402
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS089403
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS089404
Scopolamine
5 spectra
C17H21NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
303.14706
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO004012
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO004013
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO004014
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO004015
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO004016
Scopoletin
2 spectra
C10H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
192.04227
LC-ESI-QQ; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB002203
LC-ESI-QQ; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PB002204
Scopoletin, Escopoletin, Methylesculetin, Scopolet...
5 spectra
C10H8O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
192.17000
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124801
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124802
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124803
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124807
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS124808
Sebacic acid
5 spectra
C10H18O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
202.12051
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001807
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001808
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001809
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001810
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001811
Secobarbital
6 spectra
C12H18N2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.13173
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 10 V; [M-H]-
MSBNK-MSSJ-MSJ03084
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 20 V; [M-H]-
MSBNK-MSSJ-MSJ03085
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 30 V; [M-H]-
MSBNK-MSSJ-MSJ03086
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 40 V; [M-H]-
MSBNK-MSSJ-MSJ03087
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 50 V; [M-H]-
MSBNK-MSSJ-MSJ03088
LC-ESI-QQ; MS; ESI; NEGATIVE
MSBNK-MSSJ-MSJ03083
Sedoheptulose 7-phosphate
5 spectra
C7H15O10P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
290.04028
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001857
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001858
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001859
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001860
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001861
Semicarbazide
5 spectra
CH5N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
75.04326
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO004007
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO004008
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO004009
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO004010
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO004011
Ser(Ac), 2-Acetylamino-3-hydroxy-propionic acid, N...
3 spectra
C5H9NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
147.13000
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS090001
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS090002
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS090007
Ser(Ac), 3-acetyloxy-2-aminopropanoic acid, O-acet...
4 spectra
C5H9NO4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
147.13000
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS047701
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS047702
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS047703
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS047704
Serine O-sulfate
5 spectra
C3H7NO6S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
184.99940
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001135
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001136
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001137
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001138
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001139
Serotonin
5 spectra
C10H12N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
176.09496
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO004017
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO004018
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO004019
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO004020
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO004021
Simeconazole
4 spectra
C14H20FN3OSi
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
293.13596
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Waters-WA000073
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Waters-WA000074
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Waters-WA000075
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Waters-WA000076
Sinapic acid
5 spectra
C11H12O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.06847
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001822
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001823
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001824
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001825
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001826
Sinapinaldehyde, Sinapaldehyde, trans-3,5-Dimethox...
5 spectra
C11H12O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
208.21300
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS079101
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS079102
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS079103
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS079107
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS079108
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