ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000646
RECORD_TITLE: 3-ACETOXY-4'-METHOXY-6,8-DIMETHYLFLAVONE; 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$NAME: 3-ACETOXY-4'-METHOXY-6,8-DIMETHYLFLAVONE
CH$NAME: 3-ACETOXY-2-(4-METHOXYPHENYL)-6,8-DIMETHYL-4H-CHROMEN-4-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C20H18O5
CH$EXACT_MASS: 338.11542
CH$SMILES: COc(c3)ccc(c3)C(O1)=C(OC(C)=O)C(=O)c(c2)c(c(C)cc(C)2)1
CH$IUPAC: InChI=1S/C20H18O5/c1-11-9-12(2)18-16(10-11)17(22)20(24-13(3)21)19(25-18)14-5-7-15(23-4)8-6-14/h5-10H,1-4H3
CH$LINK: INCHIKEY PPEZBPVFRKFLPH-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$SPLASH: splash10-0002-0090000000-475ed9ad9742a0819eaf
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  43 2.4 24
  65 2.2 22
  77 5.6 56
  91 0.42 4
  135 3.4 34
  148 4.6 46
  149 5.3 53
  225 0.47 5
  253 2.6 26
  267 3.5 35
  268 2.1 21
  281 0.68 7
  295 15.6 156
  296 99.99 999
  297 21 210
//
