MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001295

OXALIC ACID DIBUTYL ESTER; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001295
RECORD_TITLE: OXALIC ACID DIBUTYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

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CH$NAME: OXALIC ACID DIBUTYL ESTER
CH$NAME: ETHANEDIOIC ACID DIBUTYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₈O₄
CH$EXACT_MASS: 202.12051
CH$SMILES: CCCCOC(=O)C(=O)OCCCC
CH$IUPAC: InChI=1S/C10H18O4/c1-3-5-7-13-9(11)10(12)14-8-6-4-2/h3-8H2,1-2H3
CH$LINK: INCHIKEY JKRZOJADNVOXPM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7041916

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AC$INSTRUMENT: HITACHI RMU-7M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0a4i-9000000000-1cebf8deb4734cf3a291
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  27 9.09 91
  28 5.31 53
  29 43.19 432
  30 1.3 13
  31 5.49 55
  39 4.72 47
  40 1 10
  41 49.26 493
  42 3.83 38
  43 5.78 58
  44 2.54 25
  55 6.73 67
  56 26.72 267
  57 99.99 999
  58 4.25 43
  73 1 10
//