ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000706
RECORD_TITLE: 7-METHOXYISOFLAVANONE; 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$NAME: 7-METHOXYISOFLAVANONE
CH$NAME: 7-METHOXY-3-PHENYLCHROMAN-4-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₁₄O₃
CH$EXACT_MASS: 254.09429
CH$SMILES: COc(c3)cc(O2)c(c3)C(=O)C(C2)c(c1)cccc1
CH$IUPAC: InChI=1S/C16H14O3/c1-18-12-7-8-13-15(9-12)19-10-14(16(13)17)11-5-3-2-4-6-11/h2-9,14H,10H2,1H3
CH$LINK: INCHIKEY JVMWFGYBGRWDEO-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$SPLASH: splash10-0udi-2910000000-9fbba5b003d601b0fdf1
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  28 9.9 99
  32 2 20
  39 3 30
  51 0.8 8
  63 5.6 56
  77 6 60
  78 6.3 63
  79 0.83 8
  91 2.1 21
  92 2.8 28
  94 2.3 23
  103 0.64 6
  104 16.5 165
  107 12.9 129
  122 28.1 281
  149 0.32 3
  150 99.99 999
  151 13.8 138
  254 29 290
  255 4.2 42
//