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3-chloropyrazinoic acid

View entire compound with spectra: 4 NMR

3-chloropyrazinoic acid
SpectraBase Compound ID GWvHMdu8V57
InChI InChI=1S/C5H3ClN2O2/c6-4-3(5(9)10)7-1-2-8-4/h1-2H,(H,9,10)
InChIKey PMRPVXLESNMKLG-UHFFFAOYSA-N
Mol Weight 158.54 g/mol
Molecular Formula C5H3ClN2O2
Exact Mass 157.988305 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FPphPA4MqVV
Name 3-chloropyrazinoic acid
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H3ClN2O2
InChI InChI=1S/C5H3ClN2O2/c6-4-3(5(9)10)7-1-2-8-4/h1-2H,(H,9,10)
InChIKey PMRPVXLESNMKLG-UHFFFAOYSA-N
Literature Reference Author W.HOLZER,G.A.ELLER,B.DATTERL,D.HABICHT
Literature Reference Citation MAGN.RES.CHEM.,47,617(2009)
Literature Reference DOI 10.1002/mrc.2437
Molecular Weight 158.544 g/mol
Solvent DMSO-D6
Source File Reference UWLU79823