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Name
Formula / Structure
ExactMass
ID
Walleminone
10 spectra
C15H24O3
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
252.17255
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M+H]+
MSBNK-AAFC-AC000278
LC-ESI-ITFT; MS2; CE: 10; R=17500; [M-H2O+H]+
MSBNK-AAFC-AC000283
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M+H]+
MSBNK-AAFC-AC000279
LC-ESI-ITFT; MS2; CE: 20; R=17500; [M-H2O+H]+
MSBNK-AAFC-AC000284
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-AAFC-AC000280
LC-ESI-ITFT; MS2; CE: 30; R=17500; [M-H2O+H]+
MSBNK-AAFC-AC000285
LC-ESI-ITFT; MS2; CE: 35; R=17500; [M+H]+
MSBNK-AAFC-AC000281
LC-ESI-ITFT; MS2; CE: 35; R=17500; [M-H2O+H]+
MSBNK-AAFC-AC000286
LC-ESI-ITFT; MS2; CE: 40; R=17500; [M+H]+
MSBNK-AAFC-AC000282
LC-ESI-ITFT; MS2; CE: 40; R=17500; [M-H2O+H]+
MSBNK-AAFC-AC000287
Warfarin
45 spectra
C19H16O4
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
308.10489
LC-ESI-ITFT; MS2; CE: 35; R=15000; [M+H]+
MSBNK-UFZ-UF404203
LC-ESI-ITFT; MS2; CE: 35; R=15000; [M-H]-
MSBNK-UFZ-UF404253
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
MSBNK-UFZ-UF404201
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
MSBNK-UFZ-UF404204
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M-H]-
MSBNK-UFZ-UF404251
LC-ESI-ITFT; MS2; CE: 55; R=15000; [M-H]-
MSBNK-UFZ-UF404254
LC-ESI-ITFT; MS2; CE: 80; R=15000; [M+H]+
MSBNK-UFZ-UF404202
LC-ESI-ITFT; MS2; CE: 80; R=15000; [M-H]-
MSBNK-UFZ-UF404252
LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
MSBNK-LCSB-LU037701
LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
MSBNK-LCSB-LU037751
LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
MSBNK-Eawag-EQ310301
LC-ESI-QFT; MS2; CE: 15; R=35000; [M-H]-
MSBNK-Eawag-EQ310351
LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
MSBNK-LCSB-LU037702
LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
MSBNK-LCSB-LU037752
LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
MSBNK-Eawag-EQ310302
LC-ESI-QFT; MS2; CE: 30; R=35000; [M-H]-
MSBNK-Eawag-EQ310352
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
MSBNK-CASMI_2016-SM834702
LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
MSBNK-CASMI_2016-SM834752
LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+
MSBNK-LCSB-LU037703
LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
MSBNK-LCSB-LU037753
LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
MSBNK-Eawag-EQ310303
LC-ESI-QFT; MS2; CE: 45; R=35000; [M-H]-
MSBNK-Eawag-EQ310353
LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
MSBNK-LCSB-LU037704
LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
MSBNK-LCSB-LU037754
LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
MSBNK-Eawag-EQ310304
LC-ESI-QFT; MS2; CE: 60; R=35000; [M-H]-
MSBNK-Eawag-EQ310354
LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
MSBNK-LCSB-LU037705
LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
MSBNK-LCSB-LU037755
LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
MSBNK-Eawag-EQ310305
LC-ESI-QFT; MS2; CE: 75; R=35000; [M-H]-
MSBNK-Eawag-EQ310355
LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
MSBNK-LCSB-LU037706
LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
MSBNK-LCSB-LU037756
LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
MSBNK-Eawag-EQ310306
LC-ESI-QFT; MS2; CE: 90; R=35000; [M-H]-
MSBNK-Eawag-EQ310356
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU241501
LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU241557
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU241502
LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU241558
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU241503
LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU241559
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU241504
LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU241560
LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU241505
LC-ESI-QTOF; MS2; CE: Ramp 20-30 eV; R=35000; [M+H]+
MSBNK-Athens_Univ-AU241506
LC-ESI-QTOF; MS2; CE: Ramp 24.3-36.4 eV; R=35000; [M-H]-
MSBNK-Athens_Univ-AU241562
Wighteone O-glucoside
2 spectra
C26H28O10
500.16824
ESI-TOF; MS2; CE:15 eV; [M+H]+
MSBNK-IPB_Halle-PN000106
ESI-TOF; MS2; CE:25 eV; [M+H]+
MSBNK-IPB_Halle-PN000107
Withanone
14 spectra
C28H38O6
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
470.60599
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303745
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303748
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303751
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303754
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303757
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303760
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303763
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303766
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303769
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303772
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303775
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303778
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310388
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310389
Wogonin
29 spectra
C16H12O5
Generated by the Chemistry Development Kit (http://github.com/cdk)
\n
284.06848
LC-ESI-ITTOF; MS2; [M-H]-
MSBNK-Univ_Toyama-TY000118
LC-ESI-ITTOF; MS; [M+H]+
MSBNK-Univ_Toyama-TY000033
LC-ESI-ITTOF; MS; [M-H]-
MSBNK-Univ_Toyama-TY000023
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303577
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303578
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303579
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303580
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303581
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303582
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303583
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303584
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303585
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303586
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303587
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR303588
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307444
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307445
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307446
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307447
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307448
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307449
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307450
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307451
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307452
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307453
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307454
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR307455
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR308792
LC-ESI-QTOF; MS2
MSBNK-RIKEN-PR310477
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