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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000107

dl-Tartaric acid; ESI-QTOF; MS2; CE: 20; [M-H]-

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000107
RECORD_TITLE: dl-Tartaric acid; ESI-QTOF; MS2; CE: 20; [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 20

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$SPLASH: splash10-05fu-9000000000-f1673f0f0437128e0956
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  41.003288 7.720451 77
  43.018938 79.472332 793
  44.998203 19.7965 197
  47.013853 2.84992 28
  56.998203 14.088138 140
  59.013853 54.019318 539
  72.993117 100.000002 999
  73.029503 1.760505 17
  74.000943 3.34859 33
  75.008768 6.442496 64
  87.008768 37.033298 369
  105.019332 2.616266 26
  149.009161 1.842806 18
//

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