ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006034
RECORD_TITLE: DIMETHYL SUCCINATE; 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$NAME: DIMETHYL SUCCINATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₀O₄
CH$EXACT_MASS: 146.05791
CH$SMILES: COC(=O)CCC(=O)OC
CH$IUPAC: InChI=1S/C6H10O4/c1-9-5(7)3-4-6(8)10-2/h3-4H2,1-2H3
CH$LINK: INCHIKEY MUXOBHXGJLMRAB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5025152

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$SPLASH: splash10-014i-5900000000-3fa4f2e4fd1516958b42
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  41 1 10
  43 1.11 11
  45 2.45 25
  55 28.74 287
  56 2.57 26
  57 3.87 39
  59 20.9 209
  85 1 10
  86 1.22 12
  87 13.38 134
  88 1 10
  101 1 10
  114 28.59 286
  115 99.99 999
  116 5.74 57
  146 0.08 1
//