MassBank Record: PN000083



 Biochanin A 8-C-glucoside malonylated; ESI-TOF; MS2; CE:25 eV; [M-H]- 
Mass Spectrum
Chemical Structure

ACCESSION: PN000083
RECORD_TITLE: Biochanin A 8-C-glucoside malonylated; ESI-TOF; MS2; CE:25 eV; [M-H]-
DATE: 2011.03.19
AUTHORS: , Institute of Bioorganic Chemistry, Polish Academy of Sciences,Poland/Anna Staszków
LICENSE: CC BY-SA
COPYRIGHT: Copyright(C) 2011
COMMENT: lupinus_mexico

CH$NAME: Biochanin A 8-C-glucoside malonylated CH$COMPOUND_CLASS: Natural Product; isoflavone CH$FORMULA: C25H24O13 CH$EXACT_MASS: 532.1216908279999 CH$SMILES: N/A CH$IUPAC: N/A
AC$INSTRUMENT: micrOTOF-Q AC$INSTRUMENT_TYPE: ESI-TOF AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: IONIZATION ESI AC$MASS_SPECTROMETRY: ISOLATION_WIDTH 7 AC$MASS_SPECTROMETRY: COLLISION_ENERGY 25 eV AC$MASS_SPECTROMETRY: COLLISION_GAS argon AC$MASS_SPECTROMETRY: PEAK_WIDTH 0.024 AC$MASS_SPECTROMETRY: MASS_RANGE_M/Z 49.999-1200 AC$CHROMATOGRAPHY: RETENTION_TIME 362.598 AC$CHROMATOGRAPHY: COLUMN_NAME Poroshell 120,EC-C18 2.1x100mm,2.7um
MS$FOCUSED_ION: PRECURSOR_M/Z 487.127 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]- MS$FOCUSED_ION: BASE_PEAK 325.073 MS$DATA_PROCESSING: CHARGE_DECONVOLUTION 2
PK$SPLASH: splash10-004i-0039000000-45c2f511c8025fb29820 PK$NUM_PEAK: 11 PK$PEAK: m/z int. rel.int. 282.052 239 239 283.060 66 66 297.077 165 165 298.078 23 23 325.073 999 999 326.075 141 141 337.070 51 51 355.078 75 75 367.082 41 41 427.103 66 66 487.137 35 35 //