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34,643 Hit.
( 289 - 359 Displayed )
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Name
Formula / Structure
ExactMass
ID
(S)-2-Hydroxy-2-methylsuccinic acid, L-(+)-2-Methy...
1 spectrum
C5H8O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
148.11400
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT206540
(S)-2-Hydroxy-2-methylsuccinic acid, L-(+)-2-Methy...
1 spectrum
C5H8O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
148.11400
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS065407
(S)-2-Hydroxypropionic acid
3 spectra
C3H6O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
90.03169
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000980
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000981
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT000979
(S)-3',4',5,7-Tetrahydroxyflavanone-7-(2-O-(alpha-...
6 spectra
C27H32O15
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
596.53802
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085907
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085908
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085909
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085910
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085911
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS085912
(S)-3-Amino-4-(4-hydroxyphenyl)butyric acid hydroc...
1 spectrum
C10H13NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
195.21800
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT206160
(S)-3-Amino-4-hydroxybutyric acid
1 spectrum
C4H9NO3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
119.05824
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100718
(S)-3-Amino-4-phenylbutyric acid
1 spectrum
C10H13NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
179.09464
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100782
(S)-3-Amino-5-methylhexanoic acid
1 spectrum
C7H15NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
145.11028
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100712
(S)-4'-Methoxy-3',5,7-trihydroxyflavone-7-(2-O-(al...
6 spectra
C28H34O15
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
610.56500
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086007
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086008
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086009
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086010
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086011
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS086012
(S)-5,7-Dihydroxy-4'-methoxyflavanone-7-(2-O-(alph...
2 spectra
C28H34O14
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
594.56598
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT208650
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT208653
(S)-alpha-Methylbenzeneacetic Acid, (S)-(+)-2-Phen...
1 spectrum
C9H10O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
150.17700
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS096407
(S)-Mandelic acid
5 spectra
C8H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
152.04733
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO001417
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO001418
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO001419
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO001420
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO001421
(Z)-3-Hydroxyhexadec-7-enoic acid (NMR)
1 spectrum
C16H30O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
270.21951
LC-ESI-QTOF; MS; CE:10 eV; [M-H]-
MSBNK-BS-BS001134
(Z)-3-Hydroxyoctadec-7-enoic acid (NMR)
1 spectrum
C18H34O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
298.25079
LC-ESI-QTOF; MS; CE:10 eV; [M-H]-
MSBNK-BS-BS001136
(Z)-prop-1-ene-1,2,3-tricarboxylic acid, Achilleai...
1 spectrum
C6H6O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
174.10800
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT206570
1,1,1-Trifluoro-N-((trifluoromethyl)sulfonyl)metha...
16 spectra
C2HF6NO4S2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
280.92511
LC-ESI-QTOF; MS2; 10 V
MSBNK-BAFG-CSL23111016308
LC-ESI-QTOF; MS2; 100 V
MSBNK-BAFG-CSL23111016304
LC-ESI-QTOF; MS2; 110 V
MSBNK-BAFG-CSL23111016299
LC-ESI-QTOF; MS2; 120 V
MSBNK-BAFG-CSL23111016303
LC-ESI-QTOF; MS2; 130 V
MSBNK-BAFG-CSL23111016310
LC-ESI-QTOF; MS2; 140 V
MSBNK-BAFG-CSL23111016306
LC-ESI-QTOF; MS2; 150 V
MSBNK-BAFG-CSL23111016302
LC-ESI-QTOF; MS2; 20 V
MSBNK-BAFG-CSL23111016297
LC-ESI-QTOF; MS2; 30 V
MSBNK-BAFG-CSL23111016300
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111016298
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL23111016305
LC-ESI-QTOF; MS2; 50 V
MSBNK-BAFG-CSL23111016295
LC-ESI-QTOF; MS2; 60 V
MSBNK-BAFG-CSL23111016296
LC-ESI-QTOF; MS2; 70 V
MSBNK-BAFG-CSL23111016301
LC-ESI-QTOF; MS2; 80 V
MSBNK-BAFG-CSL23111016309
LC-ESI-QTOF; MS2; 90 V
MSBNK-BAFG-CSL23111016307
1,1-Bis(3-cyclohexyl-4-hydroxyphenyl)cyclohexane
3 spectra
C30H40O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
432.30283
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002329
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002330
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002328
1,2,3,4-Butanetetracarboxylic acid
3 spectra
C8H10O8
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
234.03757
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001410
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001411
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001412
1,2,3,6-Tetrahydro-4-pyridinecarboxylic acid hydro...
1 spectrum
C6H9NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
127.14300
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT202610
1,2,3-Benzotriazole
6 spectra
C6H5N3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
119.04830
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU063451
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU063452
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU063453
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU063454
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU063455
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU063456
1,2,3-Hexanetriol
2 spectra
C6H14O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
134.09430
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002175
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002176
1,2,3-Propanetriol, Trihydroxypropane, Glycyl alco...
2 spectra
C3H8O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
92.09400
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS004807
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS004808
1,2,4-Benzenetricarboxylic acid
3 spectra
C9H6O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
210.01643
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001868
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001871
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001867
1,2,4-Butanetriol
1 spectrum
C4H10O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
106.06300
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT002474
1,2,6,6,10,17,20-heptamethyl-12-oxo-17-[(6-oxo-7,1...
2 spectra
C43H60N2O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
684.45020
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80123
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80121
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