ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000663
RECORD_TITLE: 6,7-DIMETHYL-4'-METHOXYFLAVANONE; 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$NAME: 6,7-DIMETHYL-4'-METHOXYFLAVANONE
CH$NAME: 2-(4-METHOXYPHENYL)-6,7-DIMETHYLCHROMAN-4-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₈H₁₈O₃
CH$EXACT_MASS: 282.12559
CH$SMILES: COc(c3)ccc(c3)C(C1)Oc(c2)c(cc(C)c(C)2)C(=O)1
CH$IUPAC: InChI=1S/C18H18O3/c1-11-8-15-16(19)10-17(21-18(15)9-12(11)2)13-4-6-14(20-3)7-5-13/h4-9,17H,10H2,1-3H3
CH$LINK: INCHIKEY VCYHOARLXPOAOS-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$SPLASH: splash10-001i-2950000000-fe0dee08f2cc082b1af3
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  32 5.6 56
  39 2.6 26
  65 7.3 73
  77 0.4 4
  91 29.6 296
  92 4.2 42
  119 17.4 174
  120 0.96 10
  121 15.4 154
  133 2.1 21
  134 99.99 999
  135 1.34 13
  148 32.4 324
  149 13.8 138
  175 7.5 75
  267 0.39 4
  281 25.9 259
  282 71.3 713
  283 12.1 121
//