ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009095
RECORD_TITLE: METHYL 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$NAME: METHYL LACTATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₈O₃
CH$EXACT_MASS: 104.04734
CH$SMILES: COC(=O)C(C)O
CH$IUPAC: InChI=1S/C4H8O3/c1-3(5)4(6)7-2/h3,5H,1-2H3
CH$LINK: CAS 547-64-8
CH$LINK: INCHIKEY LPEKGGXMPWTOCB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0027197

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$SPLASH: splash10-0002-9000000000-ea6a67eb1868068b29fb
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  14 1.05 11
  15 9.55 96
  19 2.67 27
  26 1.6 16
  27 8.29 83
  29 13.55 136
  30 1.95 20
  31 1.78 18
  33 14.89 149
  42 2.09 21
  43 14.27 143
  44 1.91 19
  45 99.99 999
  46 2.26 23
  55 1.2 12
  59 2.64 26
  61 2.84 28
  89 1.02 10
//