ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008472
RECORD_TITLE: 3-PHENYL-3-BUTENYL ACETATE; 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$NAME: 3-PHENYL-3-BUTENYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H14O2
CH$EXACT_MASS: 190.09938
CH$SMILES: CC(=O)OCCC(=C)c(c1)cccc1
CH$IUPAC: InChI=1S/C12H14O2/c1-10(8-9-14-11(2)13)12-6-4-3-5-7-12/h3-7H,1,8-9H2,2H3
CH$LINK: INCHIKEY RIKRCGVPSVKZJW-UHFFFAOYSA-N
AC$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: splash10-0036-6900000000-1e3c2c3c34ca47c4534f
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
  15 3.21 32
  27 2.11 21
  39 5.83 58
  41 1.94 19
  42 1.4 14
  43 98.18 982
  44 2.23 22
  50 2.42 24
  51 9.17 92
  52 1.88 19
  53 1.34 13
  63 3.81 38
  65 3.68 37
  73 1.28 13
  74 1.09 11
  75 1.55 16
  76 1.84 18
  77 10.19 102
  78 5.08 51
  79 1.19 12
  89 1.79 18
  91 16.32 163
  92 1.23 12
  102 6.43 64
  103 6.68 67
  115 33.36 334
  116 6.21 62
  117 3.79 38
  118 2.09 21
  119 1.16 12
  127 1.85 19
  128 6.86 69
  129 53.36 534
  130 99.99 999
  131 12.15 122
  190 1.83 18
//
