ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010615
RECORD_TITLE: METHYL LACTATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
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$LINK: INCHIKEY LPEKGGXMPWTOCB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0027197

AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0002-9000000000-a9c65b3fe45ba4951b60
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  15 1.2 12
  27 2.2 22
  29 2 20
  33 1.49 15
  43 4.1 41
  44 1.4 14
  45 99.99 999
  46 0.22 2
  59 1.6 16
  61 3.1 31
  89 1.6 16
  104 0.6 6
//