ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009096
RECORD_TITLE: BENZYL LACTATE; 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$NAME: BENZYL LACTATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₂O₃
CH$EXACT_MASS: 180.07864
CH$SMILES: CC(O)C(=O)OCc(c1)cccc1
CH$IUPAC: InChI=1S/C10H12O3/c1-8(11)10(12)13-7-9-5-3-2-4-6-9/h2-6,8,11H,7H2,1H3
CH$LINK: INCHIKEY ZYTLPUIDJRKAAM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID70862819

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$SPLASH: splash10-0007-9000000000-689f88442c5d3b826fe4
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  27 2.15 22
  29 2 20
  39 3.51 35
  41 1.31 13
  43 2.29 23
  45 63.2 632
  46 1.73 17
  50 1.63 16
  51 3.77 38
  52 1.33 13
  56 1.25 13
  63 2.54 25
  65 10.3 103
  77 6.22 62
  78 1.19 12
  79 3.04 30
  89 2.82 28
  90 2.77 28
  91 99.99 999
  92 15.94 159
  105 1.1 11
  107 1.77 18
  108 1.68 17
  180 3.51 35
//