ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006570
RECORD_TITLE: 2-PHENYLETHANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 2-PHENYLETHANOL
CH$NAME: PHENYLETHYL ALCOHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀O
CH$EXACT_MASS: 122.07316
CH$SMILES: OCCc(c1)cccc1
CH$IUPAC: InChI=1S/C8H10O/c9-7-6-8-4-2-1-3-5-8/h1-5,9H,6-7H2
CH$LINK: INCHIKEY WRMNZCZEMHIOCP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9026342

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$SPLASH: splash10-0006-9100000000-0ea4f78bf9f95dd3e378
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  18 2.19 22
  27 2.29 23
  29 2.55 26
  31 8.29 83
  38 1.59 16
  39 10.56 106
  41 2.2 22
  43 1.07 11
  50 4 40
  51 8.27 83
  52 2.03 20
  62 1.93 19
  63 6.31 63
  64 1.55 16
  65 18.24 182
  66 1.12 11
  77 5.4 54
  78 4.34 43
  89 2.92 29
  90 1.63 16
  91 99.99 999
  92 55.28 553
  93 4.08 41
  103 2.22 22
  104 2.25 23
  122 23.48 235
  123 1.78 18
//