ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001476
RECORD_TITLE: 1-PHENYLETHYL ALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 1-PHENYLETHYL ALCOHOL
CH$NAME: ALPHA-METHYLBENZYL ALCOHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀O
CH$EXACT_MASS: 122.07316
CH$SMILES: CC(O)c(c1)cccc1
CH$IUPAC: InChI=1S/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3
CH$LINK: INCHIKEY WAPNOHKVXSQRPX-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1020859

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-056r-9400000000-b83cdc9f65e611917295
PK$NUM_PEAK: 43
PK$PEAK: m/z int. rel.int.
  15 3.57 36
  26 1.35 14
  27 8.46 85
  28 3.13 31
  29 9.47 95
  37 1.23 12
  38 2.73 27
  39 11.39 114
  40 1.26 13
  41 1.49 15
  43 41.69 417
  44 1.65 17
  45 5.76 58
  49 1 10
  50 12.27 123
  51 28.52 285
  52 7.18 72
  53 3.89 39
  53.5 8.8 88
  60 1.21 12
  61 2.18 22
  62 4.91 49
  63 1.15 12
  64 2.87 29
  74 3.99 40
  75 2.79 28
  76 2.77 28
  77 53.05 531
  78 22.05 221
  79 99.99 999
  80 6.87 69
  89 1.45 15
  91 3.11 31
  102 1.41 14
  103 4.71 47
  104 4.01 40
  105 8.68 87
  106 1.27 13
  107 95.93 959
  108 7.78 78
  121 6.41 64
  122 32.59 326
  123 2.97 30
//