ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008477
RECORD_TITLE: CINNAMYL HEXANOATE; 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$NAME: CINNAMYL HEXANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₀O₂
CH$EXACT_MASS: 232.14633
CH$SMILES: CCCCCC(=O)OCC=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C15H20O2/c1-2-3-5-12-15(16)17-13-8-11-14-9-6-4-7-10-14/h4,6-11H,2-3,5,12-13H2,1H3/b11-8+
CH$LINK: INCHIKEY BHXVENZBMFLCKE-DHZHZOJOSA-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$SPLASH: splash10-014m-9400000000-5f892a0d4e1c3ce00577
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  27 7.53 75
  29 8.26 83
  39 8.77 88
  41 11.69 117
  42 2.78 28
  43 52.29 523
  50 1.11 11
  51 4.62 46
  55 6.46 65
  56 1.02 10
  63 2.07 21
  65 2.73 27
  69 1.37 14
  71 43.18 432
  72 1.88 19
  76 1.01 10
  77 7 70
  78 3.92 39
  79 1.42 14
  89 1.97 20
  91 14.98 150
  92 4.71 47
  99 99.99 999
  100 5.97 60
  102 1.92 19
  103 3.18 32
  104 2.26 23
  105 4.59 46
  115 40.75 408
  116 20.23 202
  117 47.64 476
  118 5.2 52
  131 1.73 17
  133 15.68 157
  134 9.06 91
  232 10.74 107
  233 1.51 15
//