ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007100
RECORD_TITLE: BENZYL LAURATE; 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$NAME: BENZYL LAURATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₉H₃₀O₂
CH$EXACT_MASS: 290.22458
CH$SMILES: CCCCCCCCCCCC(=O)OCc(c1)cccc1
CH$IUPAC: InChI=1S/C19H30O2/c1-2-3-4-5-6-7-8-9-13-16-19(20)21-17-18-14-11-10-12-15-18/h10-12,14-15H,2-9,13,16-17H2,1H3
CH$LINK: INCHIKEY QNRYOQRUGRVBRL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7059692

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$SPLASH: splash10-0006-9200000000-9cda43e1835ed556a220
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
  27 5.69 57
  29 10.2 102
  39 6.42 64
  41 27.12 271
  42 5.26 53
  43 32.16 322
  51 2.66 27
  53 1.26 13
  54 1.33 13
  55 12.8 128
  56 3.54 35
  57 20.83 208
  58 1.15 12
  63 1.58 16
  65 9.09 91
  67 2.27 23
  69 5.14 51
  70 1.39 14
  71 6.1 61
  77 4.95 50
  78 1.53 15
  79 4.68 47
  81 1.82 18
  83 5.92 59
  84 1.83 18
  85 4.03 40
  89 2.72 27
  90 5.95 60
  91 99.99 999
  92 20.23 202
  93 1.67 17
  95 2.65 27
  96 1.1 11
  97 5.42 54
  98 1.93 19
  101 1.13 11
  105 1.85 19
  107 4.36 44
  108 45.31 453
  109 4.26 43
  111 2.2 22
  125 1.37 14
  139 1.26 13
  163 2.36 24
  181 2.7 27
  183 2.82 28
  199 3.38 34
  290 1.2 12
//