ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008519
RECORD_TITLE: METHYL 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$NAME: METHYL CINNAMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₀O₂
CH$EXACT_MASS: 162.06808
CH$SMILES: COC(=O)C=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C10H10O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-8H,1H3/b8-7+
CH$LINK: INCHIKEY CCRCUPLGCSFEDV-BQYQJAHWSA-N
CH$LINK: COMPTOX DTXSID5044314

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$SPLASH: splash10-0w30-4900000000-7f967019a24723339f54
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
  15 6.57 66
  26 1.03 10
  27 2.15 22
  29 4.64 46
  30 1.14 11
  38 1.53 15
  39 3.68 37
  50 10.84 108
  51 28.22 282
  52 3.49 35
  53 1.35 14
  59 1.4 14
  62 2.11 21
  63 6.22 62
  65 1.48 15
  74 4.58 46
  75 6 60
  76 7.23 72
  77 44.73 447
  78 3.66 37
  85 1.16 12
  91 3.76 38
  101 1.58 16
  102 16.8 168
  103 61.84 618
  104 8.04 80
  105 1 10
  117 2.4 24
  121 1.43 14
  130 1.87 19
  131 99.99 999
  132 10.07 101
  147 1.38 14
  161 18.63 186
  162 49.6 496
  163 5.41 54
//