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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008326

DIMETHYL SUCCINATE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008326
RECORD_TITLE: DIMETHYL SUCCINATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
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$INSTRUMENT: HITACHI M-60
AC$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$SPLASH: splash10-066r-9400000000-cb3f9b045e51f533a8e0
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
  14 0.93 9
  15 43.36 434
  16 0.39 4
  26 2.93 29
  27 12.05 121
  28 11.76 118
  29 6.75 68
  30 0.86 9
  31 2.2 22
  39 0.63 6
  41 3.82 38
  42 3.87 39
  43 3.46 35
  44 0.41 4
  45 7.66 77
  53 0.38 4
  54 0.33 3
  55 56.49 565
  56 5.65 57
  57 5.23 52
  58 1.26 13
  59 46.41 464
  60 11.5 115
  71 0.15 2
  72 0.67 7
  74 0.4 4
  82 0.16 2
  83 1 10
  84 0.61 6
  85 1.09 11
  86 1.64 16
  87 15.84 158
  88 1.1 11
  91 0.12 1
  99 0.54 5
  101 1.09 11
  113 0.2 2
  114 28.62 286
  115 99.99 999
  116 6.57 66
  117 0.75 8
//

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