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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000108

dl-Tartaric acid; ESI-QTOF; MS2; CE: 10; [M-H]-

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000108
RECORD_TITLE: dl-Tartaric acid; ESI-QTOF; MS2; CE: 10; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: dl-Tartaric acid
CH$NAME: DTXSID5046986
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H6O6
CH$EXACT_MASS: 150.0164379252
CH$SMILES: OC(=O)C(O)C(O)C(O)=O
CH$IUPAC: InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)
CH$LINK: CAS 133-37-9
CH$LINK: CHEMSPIDER 4444097
CH$LINK: INCHIKEY FEWJPZIEWOKRBE-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:875

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10

MS$FOCUSED_ION: PRECURSOR_M/Z 149.0091614735
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-007a-9400000000-07d8d9d6fe0968df1348
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  41.003288 1.79605 17
  43.018938 27.211276 271
  44.998203 4.739278 47
  47.013853 1.715786 17
  56.998203 4.11166 41
  59.013853 41.462073 414
  72.993117 56.514194 564
  73.029503 1.055355 10
  75.008768 6.524018 65
  87.008768 100 999
  103.003682 16.766138 167
  105.019332 7.192013 71
  130.998597 2.417939 24
  149.009161 95.087229 949
//

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