ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005258
RECORD_TITLE: CINNAMIC ACID PENTYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: CINNAMIC ACID PENTYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₁₈O₂
CH$EXACT_MASS: 218.13068
CH$SMILES: CCCCCOC(=O)C=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C14H18O2/c1-2-3-7-12-16-14(15)11-10-13-8-5-4-6-9-13/h4-6,8-11H,2-3,7,12H2,1H3/b11-10+
CH$LINK: INCHIKEY QDRJCWZGTMRXCL-ZHACJKMWSA-N

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-003s-6900000000-0b9a7c379ad8dad080e6
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  27 19.83 198
  29 16.22 162
  41 17.33 173
  43 18.63 186
  51 15.62 156
  55 13.72 137
  70 35.54 355
  71 3.11 31
  76 3.81 38
  77 32.54 325
  102 11.02 110
  103 41.05 411
  104 8.62 86
  107 1.21 12
  120 1.91 19
  131 99.99 999
  132 10.52 105
  133 0.91 9
  148 56.96 570
  149 29.24 292
  218 6.22 62
  219 1.01 10
//