ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006142
RECORD_TITLE: DIETHYL OXALATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: DIETHYL OXALATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₀O₄
CH$EXACT_MASS: 146.05791
CH$SMILES: CCOC(=O)C(=O)OCC
CH$IUPAC: InChI=1S/C6H10O4/c1-3-9-5(7)6(8)10-4-2/h3-4H2,1-2H3
CH$LINK: INCHIKEY WYACBZDAHNBPPB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2044472

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-004i-9000000000-b27be2261e43ba60c92f
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  27 7.9 79
  28 8.61 86
  29 99.99 999
  30 3.55 36
  31 14.3 143
  43 2.57 26
  45 10.31 103
  56 1.06 11
  57 1.4 14
  73 1.78 18
  74 6.72 67
  75 1.28 13
  146 0.1 1
//