ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008521
RECORD_TITLE: ALLYL CINNAMATE; 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$NAME: ALLYL CINNAMATE
CH$NAME: 2-PROPENYL 3-PHENYLPROPENOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₂O₂
CH$EXACT_MASS: 188.08373
CH$SMILES: C=CCOC(=O)C=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C12H12O2/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11/h2-9H,1,10H2/b9-8+
CH$LINK: INCHIKEY KCMITHMNVLRGJU-CMDGGOBGSA-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$SPLASH: splash10-0ue9-4900000000-c9ecf6a54baed4395aa3
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  26 1.95 20
  27 7.68 77
  29 3.3 33
  38 1.92 19
  39 18.09 181
  41 16.98 170
  50 7.68 77
  51 22.1 221
  52 2.61 26
  53 1.16 12
  55 1.36 14
  62 1.26 13
  63 3.39 34
  69 2.67 27
  74 2.67 27
  75 3.16 32
  76 5.81 58
  77 46.7 467
  78 3.76 38
  91 5.81 58
  97 2.06 21
  101 1.4 14
  102 13 130
  103 59.88 599
  104 39.46 395
  105 4.54 45
  115 1.3 13
  116 1.55 16
  128 4.96 50
  129 8.29 83
  130 1.32 13
  131 99.99 999
  132 11.5 115
  133 1.43 14
  141 1.04 10
  142 3.73 37
  143 15.6 156
  144 2.11 21
  147 5.01 50
  173 2.7 27
  188 11.96 120
  189 1.47 15
//