ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008524
RECORD_TITLE: BUTYL 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$NAME: BUTYL CINNAMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₆O₂
CH$EXACT_MASS: 204.11503
CH$SMILES: CCCCOC(=O)C=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C13H16O2/c1-2-3-11-15-13(14)10-9-12-7-5-4-6-8-12/h4-10H,2-3,11H2,1H3/b10-9+
CH$LINK: INCHIKEY OHHIVLJVBNCSHV-MDZDMXLPSA-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$SPLASH: splash10-0f7k-3900000000-d8f6db7350cbe26a7677
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
  26 1.02 10
  27 9.53 95
  29 7.24 72
  39 5.02 50
  42 11.81 118
  43 1.89 19
  50 3.42 34
  51 14.32 143
  52 1.88 19
  53 1.18 12
  55 2.27 23
  56 4.03 40
  57 1.52 15
  63 2.25 23
  74 1.53 15
  75 2.24 22
  76 3.78 38
  77 36.88 369
  78 3.07 31
  91 2.78 28
  101 1.12 11
  102 12.58 126
  103 48.44 484
  104 10.48 105
  105 1.32 13
  120 2.29 23
  130 1.81 18
  131 99.99 999
  132 10.16 102
  133 1.23 12
  147 39.36 394
  148 69.31 693
  149 11.66 117
  150 1.09 11
  204 17.6 176
  205 2.41 24
//