ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009246
RECORD_TITLE: PHENYLETHYL 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$NAME: PHENYLETHYL LACTATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₄O₃
CH$EXACT_MASS: 194.09429
CH$SMILES: CC(O)C(=O)OCCc(c1)cccc1
CH$IUPAC: InChI=1S/C11H14O3/c1-9(12)11(13)14-8-7-10-5-3-2-4-6-10/h2-6,9,12H,7-8H2,1H3
CH$LINK: INCHIKEY IYXFDAOFSCZADY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID70610872

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$SPLASH: splash10-0udi-7900000000-b4302abf02cb02bf290b
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  15 1.2 12
  19 1.1 11
  27 6.6 66
  29 0.43 4
  39 4.3 43
  43 8.5 85
  45 42.5 425
  50 0.14 1
  51 6 60
  52 1.2 12
  63 1.8 18
  65 0.57 6
  77 10.9 109
  78 6.3 63
  79 7.6 76
  89 0.1 1
  91 16 160
  92 6.9 69
  103 6.5 65
  104 99.99 999
  105 38.8 388
  106 2.5 25
  122 1.8 18
//