ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009456
RECORD_TITLE: METHYL CINNAMATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: EGUCHI S, FAC. OF SCIENCE, HIROSHIMA UNIV.
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$INSTRUMENT: HITACHI RMU-7L
AC$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$SPLASH: splash10-0udi-7900000000-4a3d59402d4046246f21
PK$NUM_PEAK: 57
PK$PEAK: m/z int. rel.int.
  40 3.5 35
  41 1.5 15
  50 26 260
  51 56 560
  52 11 110
  53 3.5 35
  59 2.5 25
  61 2 20
  62 5.5 55
  63 12.5 125
  64 2 20
  65 3.5 35
  66 1 10
  67 1 10
  69 1.5 15
  73 1.5 15
  74 10 100
  75 11.5 115
  76 16.5 165
  77 61.5 615
  78 7.5 75
  79 1.5 15
  85 2.5 25
  86 1.5 15
  87 2 20
  89 2.5 25
  90 3 30
  91 8 80
  92 2.5 25
  98 2 20
  99 1.5 15
  101 3 30
  102 27 270
  103 89 890
  104 15 150
  105 2.5 25
  106 1 10
  107 1.5 15
  115 2 20
  116 2.5 25
  117 4 40
  118 2.5 25
  119 2 20
  121 2.55 26
  129 1.5 15
  130 2.5 25
  131 99.99 999
  132 11 110
  133 1.5 15
  134 2 20
  144 2 20
  145 1 10
  146 1 10
  147 2.5 25
  161 12 120
  162 38 380
  163 4 40
//