ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008496
RECORD_TITLE: 2-PHENYLETHYL BENZOATE; 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$NAME: 2-PHENYLETHYL BENZOATE
CH$NAME: PHENETHYL BENZOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H14O2
CH$EXACT_MASS: 226.09938
CH$SMILES: O=C(OCCc(c2)cccc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C15H14O2/c16-15(14-9-5-2-6-10-14)17-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2
CH$LINK: INCHIKEY OSORMYZMWHVFOZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9047590
AC$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: splash10-0udi-4900000000-47ec2ba2cea1fcfe861f
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  27 1.67 17
  39 2.48 25
  50 2.78 28
  51 13.24 132
  52 1.13 11
  63 1.11 11
  65 4.08 41
  76 1.47 15
  77 35.49 355
  78 5.44 54
  79 1.5 15
  91 7.35 74
  103 2.66 27
  104 99.99 999
  105 45.19 452
  106 2.58 26
//
