ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006260
RECORD_TITLE: BENZYL ALCOHOL; 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$NAME: BENZYL ALCOHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₈O
CH$EXACT_MASS: 108.05751
CH$SMILES: OCc(c1)cccc1
CH$IUPAC: InChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
CH$LINK: CAS 100-51-6
CH$LINK: INCHIKEY WVDDGKGOMKODPV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5020152

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-056r-9400000000-7a77e67486ae3b2dd855
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  26 2.15 22
  27 7.7 77
  28 2.31 23
  29 6.94 69
  30 0.88 9
  31 5.64 56
  37 2.29 23
  38 4.89 49
  39 14.53 145
  40 1.19 12
  41 1.11 11
  49 1.59 16
  50 14.14 141
  51 27.66 277
  52 7.52 75
  53 6.29 63
  54 0.99 10
  55 0.97 10
  61 1.7 17
  62 3.85 39
  63 8.02 80
  64 1.73 17
  65 7.39 74
  66 0.78 8
  73 0.98 10
  74 4.45 45
  75 2.56 26
  76 2.17 22
  77 53.62 536
  78 12.99 130
  79 99.99 999
  80 10.62 106
  81 0.97 10
  89 6.76 68
  90 7.81 78
  91 17.53 175
  92 1.49 15
  105 5.37 54
  106 2.4 24
  107 63.38 634
  108 88.51 885
  109 7.01 70
//