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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000106

dl-Tartaric acid; ESI-QTOF; MS2; CE: 40; [M-H]-

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000106
RECORD_TITLE: dl-Tartaric acid; ESI-QTOF; MS2; CE: 40; [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 40

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$SPLASH: splash10-0006-9000000000-c79923e068c5f2ed2d3c
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  41.003288 80.990683 809
  43.018938 99.999998 999
  44.998203 38.892155 388
  56.998203 3.729379 37
  59.013853 22.054934 220
  68.998203 5.912179 59
  72.993117 24.352248 243
//

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