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Name
Formula / Structure
ExactMass
ID
Chrysoeriol glucosylglucoside
2 spectra
C28H32O16
624.16901
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000047
ESI-TOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PN000048
Chrysoeriol O-diglucoside
1 spectrum
C28H32O16
624.16901
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000036
Chrysoeriol O-glucoside malonylated
2 spectra
C25H24O14
548.11658
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000038
ESI-TOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PN000037
Chrysoeriol O-glucosylglucoside malonylated
4 spectra
C31H34O19
710.16943
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000078
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000079
ESI-TOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PN000076
ESI-TOF; MS2; CE:25 eV; [M-H]-
MSBNK-IPB_Halle-PN000077
Chrysoidine G
3 spectra
C12H12N4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
212.10620
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M+H]+
MSBNK-ACES_SU-AS000095
LC-APCI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M-H]-
MSBNK-ACES_SU-AS000041
LC-ESI-QFT; MS2; CE: Ramp 20%-70% (nominal); R=30000; [M+H]+
MSBNK-ACES_SU-AS000165
Chrysophanic acid
9 spectra
C15H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
254.05791
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80948
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80947
LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01120
LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01163
LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
MSBNK-Washington_State_Univ-BML01132
LC-ESI-QTOF; MS2; CE 20 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01172
LC-ESI-QTOF; MS2; CE 40 ev; [M-H]-
MSBNK-Washington_State_Univ-BML01181
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80946
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80945
Chrysophanol
5 spectra
C15H10O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
254.05791
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003766
LC-ESI-ITFT; MS2; CE: 20%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003767
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003768
LC-ESI-ITFT; MS2; CE: 40%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003769
LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M+H]+
MSBNK-HBM4EU-HB003770
CI-1018
9 spectra
C24H20N4O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
396.15863
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT000606
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT000604
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT000605
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU121701
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU121702
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU121703
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU121704
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU121705
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU121706
CI-1029
18 spectra
C28H37NO4S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
483.24432
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT001749
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001748
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT001750
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001747
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT001751
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001746
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU041501
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU041551
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU041502
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU041552
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU041503
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU041553
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU041504
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU041554
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU041505
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU041555
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU041506
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU041556
CI-1044
12 spectra
C23H19N5O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
397.15387
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT001163
ESI-QTOF; MS2; CE: 10; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001164
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT001165
ESI-QTOF; MS2; CE: 20; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001166
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT001167
ESI-QTOF; MS2; CE: 40; [M-H]-
MSBNK-EPA-ENTACT_AGILENT001168
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU130501
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU130502
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU130503
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU130504
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU130505
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU130506
CI-959
15 spectra
C14H15N5O3S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
333.08957
ESI-QTOF; MS2; CE: 10; [M+H]+
MSBNK-EPA-ENTACT_AGILENT000114
ESI-QTOF; MS2; CE: 20; [M+H]+
MSBNK-EPA-ENTACT_AGILENT000112
ESI-QTOF; MS2; CE: 40; [M+H]+
MSBNK-EPA-ENTACT_AGILENT000113
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU118701
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU118751
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU118702
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU118752
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU118703
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU118753
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU118704
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU118754
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU118705
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU118755
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU118706
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU118756
Cianidanol
8 spectra
C15H14O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
290.27100
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS045501
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS045502
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS045503
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS045504
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS045507
LC-ESI-QQ; MS2
MSBNK-RIKEN_ReSpect-PS045508
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT104550
LC-ESI-QTOF; MS2
MSBNK-RIKEN_ReSpect-PT204550
Ciclopirox
4 spectra
C12H17NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
207.12593
LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
MSBNK-UFZ-WANA308611C9CFPH
LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
MSBNK-UFZ-WANA308613D9F1PH
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-UFZ-WANA3086155BE0PH
LC-ESI-QTOF; MS2; 40 V
MSBNK-BAFG-CSL2311108920
Cilastatin
38 spectra
C16H26N2O5S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
358.15619
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
MSBNK-Eawag-EA255508
LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M-H]-
MSBNK-Eawag-EA255558
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M+H]+
MSBNK-Eawag-EA255502
LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M-H]-
MSBNK-Eawag-EA255552
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
MSBNK-Eawag-EA255509
LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M-H]-
MSBNK-Eawag-EA255559
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M+H]+
MSBNK-Eawag-EA255503
LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M-H]-
MSBNK-Eawag-EA255553
LC-ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
MSBNK-Eawag-EA255514
LC-ESI-ITFT; MS2; CE: 35%; R=30000; [M-H]-
MSBNK-Eawag-EA255564
LC-ESI-ITFT; MS2; CE: 35%; R=7500; [M+H]+
MSBNK-Eawag-EA255501
LC-ESI-ITFT; MS2; CE: 35%; R=7500; [M-H]-
MSBNK-Eawag-EA255551
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
MSBNK-Eawag-EA255510
LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M-H]-
MSBNK-Eawag-EA255560
LC-ESI-ITFT; MS2; CE: 45%; R=7500; [M+H]+
MSBNK-Eawag-EA255504
LC-ESI-ITFT; MS2; CE: 45%; R=7500; [M-H]-
MSBNK-Eawag-EA255554
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
MSBNK-Eawag-EA255511
LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M-H]-
MSBNK-Eawag-EA255561
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M+H]+
MSBNK-Eawag-EA255505
LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M-H]-
MSBNK-Eawag-EA255555
LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
MSBNK-Eawag-EA255512
LC-ESI-ITFT; MS2; CE: 75%; R=7500; [M+H]+
MSBNK-Eawag-EA255506
LC-ESI-ITFT; MS2; CE: 75%; R=7500; [M-H]-
MSBNK-Eawag-EA255556
LC-ESI-ITFT; MS2; CE: 90%; R=30000; [M+H]+
MSBNK-Eawag-EA255513
LC-ESI-ITFT; MS2; CE: 90%; R=7500; [M+H]+
MSBNK-Eawag-EA255507
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU212901
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+Na]+
MSBNK-Athens_Univ-AU212930
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU212951
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU212902
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU212952
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU212903
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+Na]+
MSBNK-Athens_Univ-AU212932
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU212904
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+Na]+
MSBNK-Athens_Univ-AU212933
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+Na]+
MSBNK-Athens_Univ-AU212934
LC-ESI-QTOF; MS2; HILIC; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU212907
LC-ESI-QTOF; MS2; HILIC; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU212908
LC-ESI-QTOF; MS2; HILIC; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU212909
Ciliatine
16 spectra
C2H8NO3P
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
125.02418
GC-EI-TOF; MS; 3 TMS; BP:174
MSBNK-Kazusa-KZ000095
GC-EI-TOF; MS; 3 TMS; BP:398
MSBNK-Kazusa-KZ000004
GC-EI-TOF; MS; 3 TMS; BP:73
MSBNK-RIKEN-PR010125
GC-EI-TOF; MS; n TMS; RT:661.621 sec
MSBNK-Osaka_Univ-OUF00137
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO002168
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000108
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO002169
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000109
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO002170
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000110
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO002171
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000111
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO002172
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000112
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+
MSBNK-RIKEN-PR100079
LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
MSBNK-RIKEN-PR100520
Cimaterol
9 spectra
C12H17N3O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
219.13716
LC-ESI-QFT; MS2; CE: 120; R=35000; [M+H]+
MSBNK-Eawag-EQ365707
LC-ESI-QFT; MS2; CE: 150; R=35000; [M+H]+
MSBNK-Eawag-EQ365708
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
MSBNK-Eawag-EQ365701
LC-ESI-QFT; MS2; CE: 180; R=35000; [M+H]+
MSBNK-Eawag-EQ365709
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
MSBNK-Eawag-EQ365702
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
MSBNK-Eawag-EQ365703
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
MSBNK-Eawag-EQ365704
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
MSBNK-Eawag-EQ365705
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
MSBNK-Eawag-EQ365706
Cimetidine
37 spectra
C10H16N6S
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
252.11572
LC-ESI-IT; MS2; m/z: 253; [M+H]+
MSBNK-Keio_Univ-KO008913
LC-ESI-IT; MS3; m/z: 253/159; [M+H]+
MSBNK-Keio_Univ-KO008917
LC-ESI-IT; MS3; m/z: 253/172; [M+H]+
MSBNK-Keio_Univ-KO008916
LC-ESI-IT; MS3; m/z: 253/197; [M+H]+
MSBNK-Keio_Univ-KO008915
LC-ESI-IT; MS3; m/z: 253/211; [M+H]+
MSBNK-Keio_Univ-KO008914
LC-ESI-Q; MS; POS; 15 V
MSBNK-Waters-WA001575
LC-ESI-Q; MS; POS; 30 V
MSBNK-Waters-WA001574
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA001573
LC-ESI-Q; MS; POS; 60 V, 75 V
MSBNK-Waters-WA001572
LC-ESI-QFT; MS2; CE: 120; R=35000; [M+H]+
MSBNK-Eawag-EQ372207
LC-ESI-QFT; MS2; CE: 120; R=35000; [M-H]-
MSBNK-Eawag-EQ372257
LC-ESI-QFT; MS2; CE: 150; R=35000; [M+H]+
MSBNK-Eawag-EQ372208
LC-ESI-QFT; MS2; CE: 150; R=35000; [M-H]-
MSBNK-Eawag-EQ372258
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
MSBNK-Eawag-EQ372201
LC-ESI-QFT; MS2; CE: 15; R=35000; [M-H]-
MSBNK-Eawag-EQ372251
LC-ESI-QFT; MS2; CE: 180; R=35000; [M+H]+
MSBNK-Eawag-EQ372209
LC-ESI-QFT; MS2; CE: 180; R=35000; [M-H]-
MSBNK-Eawag-EQ372259
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
MSBNK-Eawag-EQ372202
LC-ESI-QFT; MS2; CE: 30; R=35000; [M-H]-
MSBNK-Eawag-EQ372252
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
MSBNK-Eawag-EQ372203
LC-ESI-QFT; MS2; CE: 45; R=35000; [M-H]-
MSBNK-Eawag-EQ372253
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
MSBNK-Eawag-EQ372204
LC-ESI-QFT; MS2; CE: 60; R=35000; [M-H]-
MSBNK-Eawag-EQ372254
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
MSBNK-Eawag-EQ372205
LC-ESI-QFT; MS2; CE: 75; R=35000; [M-H]-
MSBNK-Eawag-EQ372255
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
MSBNK-Eawag-EQ372206
LC-ESI-QFT; MS2; CE: 90; R=35000; [M-H]-
MSBNK-Eawag-EQ372256
LC-ESI-QQ; MS2; CE:10 V; [M+H]+
MSBNK-Keio_Univ-KO002632
LC-ESI-QQ; MS2; CE:10 V; [M-H]-
MSBNK-Keio_Univ-KO000544
LC-ESI-QQ; MS2; CE:20 V; [M+H]+
MSBNK-Keio_Univ-KO002633
LC-ESI-QQ; MS2; CE:20 V; [M-H]-
MSBNK-Keio_Univ-KO000545
LC-ESI-QQ; MS2; CE:30 V; [M+H]+
MSBNK-Keio_Univ-KO002634
LC-ESI-QQ; MS2; CE:30 V; [M-H]-
MSBNK-Keio_Univ-KO000546
LC-ESI-QQ; MS2; CE:40 V; [M+H]+
MSBNK-Keio_Univ-KO002635
LC-ESI-QQ; MS2; CE:40 V; [M-H]-
MSBNK-Keio_Univ-KO000547
LC-ESI-QQ; MS2; CE:50 V; [M+H]+
MSBNK-Keio_Univ-KO002636
LC-ESI-QQ; MS2; CE:50 V; [M-H]-
MSBNK-Keio_Univ-KO000548
Cinchonamine
4 spectra
C19H24N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
296.18887
LC-APCI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80953
LC-APCI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80952
LC-ESI-QTOF; MS; NEGATIVE
MSBNK-Washington_State_Univ-BML80951
LC-ESI-QTOF; MS; POSITIVE
MSBNK-Washington_State_Univ-BML80950
Cinchonidine
21 spectra
C19H22N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
294.39999
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02570
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02571
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02572
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA02569
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000018
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301811
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301815
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301819
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301823
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301827
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301833
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301837
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301840
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301844
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR301848
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310569
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
MSBNK-Fiocruz-FIO00806
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
MSBNK-Fiocruz-FIO00807
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
MSBNK-Fiocruz-FIO00808
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
MSBNK-Fiocruz-FIO00809
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
MSBNK-Fiocruz-FIO00810
Cinchonine
34 spectra
C19H22N2O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
294.17322
LC-ESI-ITFT; MS2; CE 35 eV; [M+H]+
MSBNK-MPI_for_Chemical_Ecology-CE000025
LC-ESI-ITFT; MS2; CE 45 eV; [M+H]+
MSBNK-MPI_for_Chemical_Ecology-CE000026
LC-ESI-ITFT; MS2; CE 55 eV; [M+H]+
MSBNK-MPI_for_Chemical_Ecology-CE000027
LC-ESI-ITFT; MS; [M+H]+; isotope pattern
MSBNK-MPI_for_Chemical_Ecology-CE000028
LC-ESI-Q; MS; POS; 15 V, 30 V
MSBNK-Waters-WA001717
LC-ESI-Q; MS; POS; 45 V
MSBNK-Waters-WA001716
LC-ESI-Q; MS; POS; 60 V
MSBNK-Waters-WA001715
LC-ESI-Q; MS; POS; 75 V, 90 V
MSBNK-Waters-WA001714
LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00498
LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00499
LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00500
LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
MSBNK-RIKEN_NPDepo-NGA00497
LC-ESI-QQQ; MS; [M+H]+
MSBNK-RIKEN_NPDepo-CB000019
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300876
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300880
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300884
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300888
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300892
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300899
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300903
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300907
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300911
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300915
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR300918
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310567
LC-ESI-QTOF; MS2; [M+H]+; CE: 10eV
MSBNK-Fiocruz-FIO00478
LC-ESI-QTOF; MS2; [M+H]+; CE: 20eV
MSBNK-Fiocruz-FIO00479
LC-ESI-QTOF; MS2; [M+H]+; CE: 30eV
MSBNK-Fiocruz-FIO00480
LC-ESI-QTOF; MS2; [M+H]+; CE: 40eV
MSBNK-Fiocruz-FIO00481
LC-ESI-QTOF; MS2; [M+H]+; CE: 50eV
MSBNK-Fiocruz-FIO00482
LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
MSBNK-IPB_Halle-PB005841
LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PB005842
LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
MSBNK-IPB_Halle-PB005843
LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
MSBNK-IPB_Halle-PB005844
Cinchophen
12 spectra
C16H11NO2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
249.07899
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU105101
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU105151
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU105102
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU105152
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU105103
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU105153
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU105104
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU105154
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU105105
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU105155
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU105106
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU105156
CINNAMALDEHYDE
3 spectra
C9H8O
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
132.05751
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP002122
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008083
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008705
CINNAMALDEHYDE DIETHYL ACETAL
1 spectrum
C13H18O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
206.13068
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008464
CINNAMALDEHYDE DIMETHYL ACETAL
1 spectrum
C11H14O2
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
178.09938
EI-B; MS
MSBNK-Fac_Eng_Univ_Tokyo-JP008462
Cinnamamide
1 spectrum
C9H9NO
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
147.06841
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM817801
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