MassBank Record: JP000648



 6,8-DIMETHYL-3',4'-METHYLENEDIOXYFLAVONOL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000648
RECORD_TITLE: 6,8-DIMETHYL-3',4'-METHYLENEDIOXYFLAVONOL; 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$NAME: 6,8-DIMETHYL-3',4'-METHYLENEDIOXYFLAVONOL CH$NAME: 3-HYDROXY-6,8-DIMETHYL-2-(3,4-METHYLENEDIOXYPHENYL)-4H-CHROMEN-4-ONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C18H14O5 CH$EXACT_MASS: 310.08412 CH$SMILES: Cc(c4)cc(C(=O)3)c(c(C)4)OC(=C(O)3)c(c1)cc(O2)c(OC2)c1 CH$IUPAC: InChI=1S/C18H14O5/c1-9-5-10(2)17-12(6-9)15(19)16(20)18(23-17)11-3-4-13-14(7-11)22-8-21-13/h3-7,20H,8H2,1-2H3
AC$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: splash10-03di-1109000000-5be5eb76c8d8556f4c23 PK$NUM_PEAK: 20 PK$PEAK: m/z int. rel.int. 63 2.3 23 65 4.7 47 76 2.9 29 77 0.45 5 91 8.1 81 119 3.8 38 120 3.8 38 126 0.49 5 133 2.1 21 140 11.1 111 149 14.2 142 162 0.51 5 224 5.2 52 253 3.6 36 281 4.2 42 282 0.83 8 309 34 340 310 99.99 999 311 28.9 289 312 2.9 29 //