MassBank Record: MSBNK-IPB_Halle-PN000049
ACCESSION: MSBNK-IPB_Halle-PN000049
RECORD_TITLE: Chrysoeriol 8-C-glucoside malonylated; 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$NAME: Chrysoeriol 8-C-glucoside malonylated
CH$COMPOUND_CLASS: Natural Product; flavone
CH$FORMULA: C25H25O14
CH$EXACT_MASS: 549.12443048
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 44.9266-1004.94
AC$CHROMATOGRAPHY: RETENTION_TIME 312.636 sec
AC$CHROMATOGRAPHY: COLUMN_NAME Poroshell 120,EC-C18 2.1x100mm,2.7um
MS$FOCUSED_ION: PRECURSOR_M/Z 549.127
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$FOCUSED_ION: BASE_PEAK 549.116
MS$DATA_PROCESSING: CHARGE_DECONVOLUTION 2
PK$SPLASH: splash10-0002-0003490000-f809bea7a9bed1745fe2
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
313.0685 17 17
325.0721 59 59
343.0831 292 292
344.0860 66 66
355.0774 14 14
367.0825 203 203
368.0888 33 33
373.0963 71 71
381.1048 29 29
391.0830 49 49
409.0902 152 152
410.0976 32 32
427.1022 78 78
428.1083 14 14
445.1190 67 67
463.1208 49 49
469.1146 275 275
470.1201 50 50
487.1297 179 179
488.1286 48 48
489.1241 20 20
495.0997 16 16
505.1336 118 118
506.1462 16 16
513.1096 153 153
514.1100 33 33
531.1113 275 275
532.1183 82 82
533.1229 16 16
549.1269 999 999
550.1274 209 209
551.1304 40 40
//