ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000645
RECORD_TITLE: 4'-METHOXY-6,8-DIMETHYLFLAVONOL; 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$NAME: 4'-METHOXY-6,8-DIMETHYLFLAVONOL
CH$NAME: 3-HYDROXY-2-(4-METHOXYPHENYL)-6,8-DIMETHYL-4H-CHROMEN-4-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H16O4
CH$EXACT_MASS: 296.10486
CH$SMILES: COc(c3)ccc(c3)C(O1)=C(O)C(=O)c(c2)c(c(C)cc(C)2)1
CH$IUPAC: InChI=1S/C18H16O4/c1-10-8-11(2)17-14(9-10)15(19)16(20)18(22-17)12-4-6-13(21-3)7-5-12/h4-9,20H,1-3H3
CH$LINK: INCHIKEY QZGAIHVBUJBVAJ-UHFFFAOYSA-N
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$SPLASH: splash10-0002-0090000000-72f164ece7d752736675
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  77 4.8 48
  91 3.7 37
  135 2.3 23
  148 0.79 8
  149 9.1 91
  225 4.6 46
  253 3 30
  281 0.77 8
  295 16.7 167
  296 99.99 999
  297 16.9 169
//
