ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004007
RECORD_TITLE: DIETHYL OXALATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
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$INSTRUMENT: HITACHI RMU-6L
AC$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$SPLASH: splash10-004i-9000000000-ea070f5519916dcaa16b
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  15 2 20
  26 2.9 29
  27 13.2 132
  28 0.92 9
  29 99.99 999
  30 2.8 28
  31 16.2 162
  41 0.28 3
  43 3.8 38
  45 13 130
  46 3.2 32
  47 0.31 3
  56 2.4 24
  57 2.3 23
  59 2.2 22
  73 0.21 2
  74 10 100
  75 2.5 25
//