ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008522
RECORD_TITLE: PROPYL 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$NAME: PROPYL CINNAMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₄O₂
CH$EXACT_MASS: 190.09938
CH$SMILES: CCCOC(=O)C=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C12H14O2/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3/b9-8+
CH$LINK: INCHIKEY OLLPXZHNCXACMM-CMDGGOBGSA-N
CH$LINK: COMPTOX DTXSID00225514

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$SPLASH: splash10-0f8a-3900000000-38ffea49b62d2233a8d1
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  26 1 10
  27 12.51 125
  29 3.3 33
  39 4.64 46
  41 7.65 77
  42 1.58 16
  43 3.6 36
  50 4 40
  51 16.41 164
  52 2.17 22
  63 2.68 27
  74 1.96 20
  75 2.61 26
  76 3.76 38
  77 37.27 373
  78 3.03 30
  91 3.08 31
  101 1.25 13
  102 14.32 143
  103 49.72 497
  104 12.18 122
  105 1.39 14
  120 1.89 19
  130 1.84 18
  131 99.99 999
  132 10.57 106
  133 1.5 15
  146 1.15 12
  147 33.19 332
  148 49.21 492
  149 4.62 46
  190 16.51 165
  191 1.77 18
//