ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008064
RECORD_TITLE: CINNAMIC ACID ALLYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: CINNAMIC ACID ALLYL ESTER
CH$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$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0f89-1900000000-796bb20579066057a1b7
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
  39 1.02 10
  41 6.46 65
  55 1.19 12
  66 1.02 10
  69 3.4 34
  77 10.88 109
  78 1.7 17
  82 1.02 10
  84 1.02 10
  91 5.27 53
  92 1.02 10
  97 2.89 29
  102 2.55 26
  103 40.31 403
  104 45.58 456
  105 4.76 48
  115 1.53 15
  116 2.38 24
  117 1.19 12
  128 6.12 61
  129 10.03 100
  130 2.21 22
  131 99.99 999
  132 12.42 124
  133 2.04 20
  141 1.36 14
  142 6.46 65
  143 22.62 226
  144 3.91 39
  146 6.97 70
  147 2.21 22
  160 1.19 12
  169 1.19 12
  170 1.19 12
  173 4.59 46
  187 1.02 10
  188 28.74 287
  189 4.25 43
  190 1.19 12
//