MassBank Record: MSBNK-IPB_Halle-PN000053
ACCESSION: MSBNK-IPB_Halle-PN000053
RECORD_TITLE: Genistein C,O-diglucoside; ESI-TOF; MS2; CE:15 eV; [M+H]+
DATE: 2011.03.18
AUTHORS: Institute of Bioorganic Chemistry, Polish Academy of Sciences,Poland/Anna Staszków
LICENSE: CC BY-SA
COPYRIGHT: Copyright(C) 2011
COMMENT: lupinus_mexico
CH$NAME: Genistein C,O-diglucoside
CH$COMPOUND_CLASS: Natural Product; isoflavone
CH$FORMULA: C27H30O15
CH$EXACT_MASS: 594.15847026
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 POSITIVE
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 15 eV
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: ISOLATION_WIDTH 7
AC$MASS_SPECTROMETRY: COLLISION_GAS argon
AC$MASS_SPECTROMETRY: PEAK_WIDTH 0.018
AC$MASS_SPECTROMETRY: MASS_RANGE_M/Z 49.999-1000
AC$CHROMATOGRAPHY: RETENTION_TIME 142.34 sec
AC$CHROMATOGRAPHY: COLUMN_NAME Poroshell 120,EC-C18 2.1x100mm,2.7um
MS$FOCUSED_ION: PRECURSOR_M/Z 595.168
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$FOCUSED_ION: BASE_PEAK 433.112
MS$DATA_PROCESSING: CHARGE_DECONVOLUTION 2
PK$SPLASH: splash10-001j-0000940000-496d9c8bd181a0b53e0e
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
271.0620 44 44
397.0917 105 105
398.0958 29 29
415.1033 357 357
416.1068 65 65
433.1124 999 999
434.1172 165 165
435.1210 35 35
595.1671 705 705
596.1685 144 144
597.1751 42 42
//
system version 2.2.6-SNAPSHOT