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LC-ESI-QQ
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9,615 Hit.
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Name
Formula / Structure
ExactMass
ID
Sisomicin
15 spectra
C19H37N5O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
447.26929
LC-ESI-QQ; MS2; CE:10 V; [M+2H]++
MSBNK-Keio_Univ-KO004037
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO004032
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001832
LC-ESI-QQ; MS2; CE:20 V; [M+2H]++
MSBNK-Keio_Univ-KO004038
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO004033
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001833
LC-ESI-QQ; MS2; CE:30 V; [M+2H]++
MSBNK-Keio_Univ-KO004039
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO004034
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001834
LC-ESI-QQ; MS2; CE:40 V; [M+2H]++
MSBNK-Keio_Univ-KO004040
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO004035
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001835
LC-ESI-QQ; MS2; CE:50 V; [M+2H]++
MSBNK-Keio_Univ-KO004041
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO004036
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001836
sn-Glycero-3-phosphocholine
5 spectra
[C8H21NO6P]+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
258.11066
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003019
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003020
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003021
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003022
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003023
Sodium pyruvate, Pyruvic acid sodium salt, Acetylf...
2 spectra
C3H4O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
88.06200
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS007801
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS007802
Solasod-5-en-3beta-ol, Purapuridine, Solancarpidin...
5 spectra
C27H43NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
413.64600
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS087301
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS087302
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS087303
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS087304
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS087305
Specitinomycin
5 spectra
C14H24N2O7
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
332.15836
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO004027
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO004028
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO004029
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO004030
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO004031
Spermidine
5 spectra
C7H19N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
145.15790
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003972
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003973
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003974
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003975
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003976
Spermine
5 spectra
C10H26N4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
202.21574
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003977
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003978
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003979
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003980
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003981
Sphinganine, C18-Dihydrosphingosine, safingol , Oc...
12 spectra
C18H39NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
301.51501
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS075001
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS075002
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS075003
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS075004
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS075005
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS075006
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081902
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081903
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081904
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081905
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS081906
Sphingosine-1-Phosphate, Sphing-4-enine-1-phosphat...
1 spectrum
C18H38NO5P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
379.48001
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS082203
Spiperone
12 spectra
C23H26FN3O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
395.20090
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 10 V; [M-H]-
MSBNK-MSSJ-MSJ03037
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 20 V; [M-H]-
MSBNK-MSSJ-MSJ03038
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 30 V; [M-H]-
MSBNK-MSSJ-MSJ03039
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 40 V; [M-H]-
MSBNK-MSSJ-MSJ03040
LC-ESI-QQ; MS2; ESI; NEGATIVE; CID; CE 50 V; [M-H]-
MSBNK-MSSJ-MSJ03041
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 10 V; [M+H]+
MSBNK-MSSJ-MSJ03031
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 20 V; [M+H]+
MSBNK-MSSJ-MSJ03032
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 30 V; [M+H]+
MSBNK-MSSJ-MSJ03033
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 40 V; [M+H]+
MSBNK-MSSJ-MSJ03034
LC-ESI-QQ; MS2; ESI; POSITIVE; CID; CE 50 V; [M+H]+
MSBNK-MSSJ-MSJ03035
LC-ESI-QQ; MS; ESI; NEGATIVE
MSBNK-MSSJ-MSJ03036
LC-ESI-QQ; MS; ESI; POSITIVE
MSBNK-MSSJ-MSJ03030
Spiraeoside, Spiraein, quercetin-4'-glucoside, Que...
11 spectra
C21H20O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
464.37900
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086901
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086902
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086903
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086904
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086905
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086906
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086907
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086908
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086909
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086910
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086911
Stachyose n-Hydrate, alpha-D-Gal-(1-6)-alpha-D-Gal...
6 spectra
C24H42O21
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
666.57898
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS126207
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS126208
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS126209
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS126210
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS126211
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS126212
steviolbioside
3 spectra
C32H50O13
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
642.32513
LC-ESI-QQ; MS2; CE:20V; [M-H]-
MSBNK-Fukuyama_Univ-FU000298
LC-ESI-QQ; MS2; CE:40V; [M-H]-
MSBNK-Fukuyama_Univ-FU000299
LC-ESI-QQ; MS2; CE:60V; [M-H]-
MSBNK-Fukuyama_Univ-FU000300
steviolmonoside
3 spectra
C26H40O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
480.27231
LC-ESI-QQ; MS2; CE:20V; [M-H]-
MSBNK-Fukuyama_Univ-FU000295
LC-ESI-QQ; MS2; CE:40V; [M-H]-
MSBNK-Fukuyama_Univ-FU000296
LC-ESI-QQ; MS2; CE:60V; [M-H]-
MSBNK-Fukuyama_Univ-FU000297
stevioside
3 spectra
C38H60O18
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
804.37799
LC-ESI-QQ; MS2; CE:20V; [M-H]-
MSBNK-Fukuyama_Univ-FU000316
LC-ESI-QQ; MS2; CE:40V; [M-H]-
MSBNK-Fukuyama_Univ-FU000317
LC-ESI-QQ; MS2; CE:60V; [M-H]-
MSBNK-Fukuyama_Univ-FU000318
Streptomycin
15 spectra
C21H39N7O12
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
581.26569
LC-ESI-QQ; MS2; CE:10 V; [M+2H]++
MSBNK-Keio_Univ-KO004002
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003997
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001827
LC-ESI-QQ; MS2; CE:20 V; [M+2H]++
MSBNK-Keio_Univ-KO004003
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003998
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001828
LC-ESI-QQ; MS2; CE:30 V; [M+2H]++
MSBNK-Keio_Univ-KO004004
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003999
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001829
LC-ESI-QQ; MS2; CE:40 V; [M+2H]++
MSBNK-Keio_Univ-KO004005
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO004000
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001830
LC-ESI-QQ; MS2; CE:50 V; [M+2H]++
MSBNK-Keio_Univ-KO004006
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO004001
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001831
Suberic acid
10 spectra
C8H14O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.08920
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003982
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001794
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003983
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001795
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003984
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001796
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003985
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001797
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003986
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001798
Suberic acid bis(N-hydroxysuccinimide ester), DSS,...
1 spectrum
C16H20N2O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
368.34201
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS094901
Suberic acid, Octanedioic acid, Suberate, Cork Aci...
4 spectra
C8H14O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.19600
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS079401
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS079402
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS079407
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS079408
Succinic acid
5 spectra
C4H6O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
118.02661
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001784
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001785
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001786
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001787
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001788
Succinic acid, Asuccin, Dicarboxylic Acid C4, 1,2-...
1 spectrum
C4H6O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
118.08800
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS034407
Succinimide
5 spectra
C4H5NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
99.03203
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001802
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001803
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001804
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001805
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001806
Succinylcholine
5 spectra
[C14H30N2O4]2+
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
290.22055
LC-ESI-QQ; MS2; CE:10 V; M++
MSBNK-Keio_Univ-KO004062
LC-ESI-QQ; MS2; CE:20 V; M++
MSBNK-Keio_Univ-KO004063
LC-ESI-QQ; MS2; CE:30 V; M++
MSBNK-Keio_Univ-KO004064
LC-ESI-QQ; MS2; CE:40 V; M++
MSBNK-Keio_Univ-KO004065
LC-ESI-QQ; MS2; CE:50 V; M++
MSBNK-Keio_Univ-KO004066
Sulfanilamide
5 spectra
C6H8N2O2S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
172.03065
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO003992
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO003993
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO003994
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO003995
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO003996
Sulfanilic acid
5 spectra
C6H7NO3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
173.01466
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001847
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001848
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001849
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001850
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001851
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