ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008544
RECORD_TITLE: DIPHENYLMETHYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: DIPHENYLMETHYL ACETATE
CH$NAME: ALPHA-PHENYLBENZYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₄O₂
CH$EXACT_MASS: 226.09938
CH$SMILES: CC(=O)OC(c(c2)cccc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C15H14O2/c1-12(16)17-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,1H3
CH$LINK: INCHIKEY QBKMWJRMLACRJD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID90914026

AC$INSTRUMENT: HITACHI M-80B
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0006-9000000000-c8776d5c7623a6af3f84
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  39 5.79 58
  41 1.95 20
  50 1.13 11
  51 3.9 39
  52 1.24 12
  63 3.31 33
  64 1.03 10
  65 14.85 149
  77 2.95 30
  89 3.02 30
  90 2.14 21
  91 99.99 999
  92 7.68 77
  108 1.12 11
  226 1.97 20
//