ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004946
RECORD_TITLE: BENZYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: BENZYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀O₂
CH$EXACT_MASS: 150.06808
CH$SMILES: CC(=O)OCc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10O2/c1-8(10)11-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
CH$LINK: CAS 140-11-4
CH$LINK: INCHIKEY QUKGYYKBILRGFE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0020151

AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-052f-9500000000-841f27b9e65e2ce89c1a
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
  42 3.51 35
  43 47.7 477
  44 3.2 32
  45 1.29 13
  50 4.38 44
  51 11.24 112
  52 2.47 25
  53 1.02 10
  62 1.36 14
  63 4.88 49
  64 1.58 16
  65 11.59 116
  74 1.23 12
  77 15.47 155
  78 4.05 41
  79 23.19 232
  80 2.29 23
  89 10.82 108
  90 43.13 431
  91 49.95 500
  92 4 40
  105 5.68 57
  106 3.21 32
  107 17.13 171
  108 99.99 999
  109 8.13 81
  150 24.81 248
  151 2.72 27
//