MassBank Record: JP000652



 6,7-DIMETHOXYFLAVONOL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000652
RECORD_TITLE: 6,7-DIMETHOXYFLAVONOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKATORI M, DEPT. OF CHEMISTRY, FAC. OF EDUC., FUKUSHIMA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 6,7-DIMETHOXYFLAVONOL CH$NAME: 3-HYDROXY-6,7-DIMETHOXY-2-PHENYL-4H-CHROMEN-4-ONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H14O5 CH$EXACT_MASS: 298.08412 CH$SMILES: COc(c1)c(OC)cc(C(=O)2)c1OC(c(c3)cccc3)=C(O)2 CH$IUPAC: InChI=1S/C17H14O5/c1-20-13-8-11-12(9-14(13)21-2)22-17(16(19)15(11)18)10-6-4-3-5-7-10/h3-9,19H,1-2H3
AC$INSTRUMENT: JEOL JMS-06-H AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0002-2290000000-21a48b9b6f05b41c2b63 PK$NUM_PEAK: 25 PK$PEAK: m/z int. rel.int. 28 9.7 97 39 2.7 27 50 3.8 38 51 0.62 6 53 3.3 33 63 2.4 24 69 4 40 77 1.9 19 78 5.1 51 89 2.3 23 105 28.9 289 106 0.22 2 109 2.1 21 137 6.5 65 149 10 100 165 1.11 11 211 7.4 74 255 8.6 86 269 4.2 42 270 0.43 4 283 3.3 33 297 25.7 257 298 99.99 999 299 2.65 27 300 2.5 25 //