ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005867
RECORD_TITLE: DIETHYL OXALATE; 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$NAME: DIETHYL OXALATE
CH$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$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-004i-9000000000-a3ebbf24365dbe4362f0
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  15 2.75 28
  26 1.9 19
  27 15.65 157
  28 9.3 93
  29 99.99 999
  30 3.17 32
  31 14.17 142
  43 2.33 23
  45 11.42 114
  56 1.06 11
  57 1.69 17
  59 1.48 15
  73 2.33 23
  74 8.88 89
  75 2.11 21
  146 0.42 4
//