ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008580
RECORD_TITLE: PHENYLETHYLENE GLYCOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: PHENYLETHYLENE GLYCOL
CH$NAME: STYRENE GLYCOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₀O₂
CH$EXACT_MASS: 138.06808
CH$SMILES: OCC(O)c(c1)cccc1
CH$IUPAC: InChI=1S/C8H10O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8-10H,6H2
CH$LINK: INCHIKEY PWMWNFMRSKOCEY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8042422

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$SPLASH: splash10-056r-9300000000-61822d25222e868a93ae
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  15 1.16 12
  27 4.74 47
  28 3.45 35
  29 11.31 113
  30 1.67 17
  31 10.26 103
  32 1.03 10
  38 1.77 18
  39 7.21 72
  41 1.29 13
  43 1.85 19
  50 6.6 66
  51 23.68 237
  52 5.18 52
  53 3.32 33
  62 1.3 13
  63 3.91 39
  65 2.85 29
  74 1.93 19
  75 1.55 16
  76 1.33 13
  77 64.59 646
  78 12.31 123
  79 88.58 886
  80 4.95 50
  89 2.39 24
  90 1.04 10
  91 5.52 55
  105 8.5 85
  106 3.83 38
  107 99.99 999
  108 6.55 66
  138 4.06 41
//