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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003893

SUCCINIC ACID; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003893
RECORD_TITLE: SUCCINIC ACID; 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$NAME: SUCCINIC ACID
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H6O4
CH$EXACT_MASS: 118.02661
CH$SMILES: OC(=O)CCC(O)=O
CH$IUPAC: InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
CH$LINK: INCHIKEY KDYFGRWQOYBRFD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6023602

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-004i-9000000000-93b4807ae6275a3e59d7
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  17 6.3 63
  18 27.5 275
  25 3.3 33
  26 1.6 16
  27 15.5 155
  28 99.99 999
  29 4.6 46
  32 0.25 3
  36 2.7 27
  41 2.8 28
  42 3.1 31
  43 0.29 3
  44 2.9 29
  53 2.8 28
  55 4 40
  56 4.43 44
  57 3.2 32
  73 3.1 31
  74 1.8 18
  100 2.6 26
//

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