ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001280
RECORD_TITLE: BENZYL ALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
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$LINK: INCHIKEY WVDDGKGOMKODPV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5020152

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-056r-9400000000-77cec715500da9c57a84
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  26 1.19 12
  27 6.14 61
  28 2.57 26
  29 4.01 40
  31 3.26 33
  37 1.63 16
  38 3.26 33
  39 12.47 125
  40 1.13 11
  41 1.13 11
  49 1.13 11
  50 11.34 113
  51 24.69 247
  52 6.58 66
  53 6.52 65
  54 1.19 12
  61 1.19 12
  62 2.57 26
  63 5.64 56
  64 1.25 13
  65 7.27 73
  74 3.07 31
  75 2.07 21
  76 1.57 16
  77 53.88 539
  78 10.71 107
  79 99.99 999
  80 9.09 91
  89 6.27 63
  90 7.64 76
  91 16.73 167
  92 2.13 21
  105 5.33 53
  106 2.51 25
  107 62.41 624
  108 82.46 825
  109 5.95 60
//