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Name
Formula / Structure
ExactMass
ID
O-Succinyl-L-Homoserine
3 spectra
C8H13NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
219.07430
EI-B; MS; n TMS; RT: 840.63 s
GLS00082
GC-EI-TOF; MS; n TMS; RT:785.748 sec
OUF00405
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+
PR100299
O-Succinylhomoserine, O-Succinyl-L-homoserine, (2S...
4 spectra
C8H13NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
219.19299
LC-ESI-QQ; MS2
PS064001
LC-ESI-QQ; MS2
PS064002
LC-ESI-QQ; MS2
PS064003
LC-ESI-QQ; MS2
PS064004
O-Succinylhomoserine, O-Succinyl-L-homoserine, (2S...
1 spectrum
C8H13NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
219.19299
LC-ESI-QTOF; MS2
PT106400
O-T-BUTYLCYCLOHEXYL ACETATE (CIS)
1 spectrum
C12H22O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
198.16199
EI-B; MS
JP000126
O-T-BUTYLCYCLOHEXYL ACETATE (TRANS)
1 spectrum
C12H22O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
198.16199
EI-B; MS
JP000127
o-Toluic acid
6 spectra
C8H8O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
136.05243
EI-B; MS; 1 TMS; RT: 481.85 s
GLS00144
GC-EI-TOF; MS; n TMS; RT:459.609 sec
OUF00035
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
KO001909
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
KO001910
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
KO001911
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
KO001912
o-Toluidine
1 spectrum
C7H9N
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
107.07350
LC-ESI-QFT; MS2; CE: 61.67%; R=35000; [M+H]+
UA007201
O-TRIMETHYLSILYL-N-DI-TRIMETHYLSILYLAMINOETHANOL
1 spectrum
C11H31OSi3
263.16827
EI-B; MS
JP004556
O2,2'-Cyclouridine
4 spectra
C9H10N2O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
226.05898
LC-APCI-QTOF; MS; NEGATIVE
BML81843
LC-APCI-QTOF; MS; POSITIVE
BML81842
LC-ESI-QTOF; MS; NEGATIVE
BML81841
LC-ESI-QTOF; MS; POSITIVE
BML81840
Obtusinin
4 spectra
C15H18O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
294.30710
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
NGA02978
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
NGA02979
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
NGA02980
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
NGA02977
Ochratoxin A
15 spectra
C20H18ClNO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
403.08224
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
AC000204
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+Na]+
AC000209
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+
AC000205
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+Na]+
AC000210
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
AC000206
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+Na]+
AC000211
LC-ESI-ITFT; MS2; CE: 35; R=17500; [M+H]+
AC000207
LC-ESI-ITFT; MS2; CE: 35; R=17500; [M+Na]+
AC000212
LC-ESI-ITFT; MS2; CE: 50; R=17500; [M+H]+
AC000208
LC-ESI-ITFT; MS2; CE: 50; R=17500; [M+Na]+
AC000213
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
AU596600
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
AU596601
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
AU596602
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
AU596603
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
AU596604
Ochratoxin B
5 spectra
C20H19NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
369.12122
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
AC000791
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+
AC000792
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
AC000793
LC-ESI-ITFT; MS2; CE: 40; R=17500; [M+H]+
AC000794
LC-ESI-ITFT; MS2; CE: 55; R=17500; [M+H]+
AC000795
Ochratoxin B ethyl ester
5 spectra
C22H23NO6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
397.15253
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
AC000796
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+
AC000797
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
AC000798
LC-ESI-ITFT; MS2; CE: 40; R=17500; [M+H]+
AC000799
LC-ESI-ITFT; MS2; CE: 55; R=17500; [M+H]+
AC000800
OCIMENOL
1 spectrum
C10H18O
154.13577
EI-B; MS
JP008386
OCP_186.0317_15.9
6 spectra
C8H8ClNO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
185.02440
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
ET130701
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
ET130702
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
ET130703
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
ET130704
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
ET130705
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
ET130706
OCP_197.0840_11.1
5 spectra
C10H13ClN2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
196.07671
LC-ESI-QFT; MS2; CE: 15-90; R=17500; [M+H]+
ET130001
LC-ESI-QFT; MS2; CE: 15-90; R=17500; [M+H]+
ET130002
LC-ESI-QFT; MS2; CE: 15-90; R=17500; [M+H]+
ET130003
LC-ESI-QFT; MS2; CE: 15-90; R=17500; [M+H]+
ET130004
LC-ESI-QFT; MS2; CE: 15-90; R=17500; [M+H]+
ET130005
OCP_211.0633_14.3
6 spectra
C10H11ClN2O
210.05600
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
ET131201
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
ET131202
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
ET131203
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
ET131204
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
ET131205
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
ET131206
OCP_211.0633_15.3
6 spectra
C10H11ClN2O
210.05600
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
ET130801
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
ET130802
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
ET130803
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
ET130804
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
ET130805
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
ET130806
OCP_213.0790_13.3
1 spectrum
C10H13ClN2O
212.07159
LC-ESI-QFT; MS2; CE: (160-0.41mz or 15) NCE; R=17500; [M+H]+
ET131002
OCP_225.0789_16.6
6 spectra
C11H13ClN2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
224.07159
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
ET130401
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
ET130402
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
ET130403
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
ET130404
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
ET130405
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
ET130406
OCP_239.0946_17.0
6 spectra
C12H15ClN2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
238.08730
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
ET130101
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
ET130102
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
ET130103
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
ET130104
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
ET130105
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
ET130106
OCP_283.0845_16.2
6 spectra
C13H15ClN2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
282.07709
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
ET130601
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
ET130602
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
ET130603
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
ET130604
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
ET130605
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
ET130606
OCP_295.0845_17.0
6 spectra
C14H15ClN2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
294.07709
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
ET130301
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
ET130302
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
ET130303
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
ET130304
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
ET130305
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
ET130306
OCP_297.1002_16.5
6 spectra
C14H17ClN2O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
296.09280
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
ET130201
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
ET130202
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
ET130203
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
ET130204
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
ET130205
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
ET130206
Oct-1-en-3-yl Ara (1-6)Glu (NMR)
2 spectra
C19H34O10
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
422.21521
LC-ESI-QTOF; MS2; CE:33 eV; [M-H]-
BS001010
LC-ESI-QTOF; MS; CE:10 eV; [M-H]-
BS001011
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