ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006921
RECORD_TITLE: PHENYL PROPIONATE; 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$NAME: PHENYL PROPIONATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀O₂
CH$EXACT_MASS: 150.06808
CH$SMILES: CCC(=O)Oc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10O2/c1-2-9(10)11-8-6-4-3-5-7-8/h3-7H,2H2,1H3
CH$LINK: INCHIKEY DYUMLJSJISTVPV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7060916

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$SPLASH: splash10-002f-9000000000-58fb3efeca6152d0c476
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  26 2.23 22
  27 12.95 130
  28 2.68 27
  29 40.2 402
  38 2.66 27
  39 17.33 173
  40 1.81 18
  50 2.25 23
  51 5.83 58
  55 2.13 21
  56 1.92 19
  57 46.23 462
  58 1.36 14
  62 1.03 10
  63 3.38 34
  64 1.26 13
  65 13.23 132
  66 8.08 81
  77 6.24 62
  93 1.21 12
  94 99.99 999
  95 7.23 72
  150 15.48 155
  151 1.39 14
//