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6-CHLORO-3,5-DIAMINOPYRAZINECARBOXYLIC ACID
SpectraBase Compound ID 9aqB5LOCJbA
InChI InChI=1S/C5H5ClN4O2/c6-2-4(8)10-3(7)1(9-2)5(11)12/h(H,11,12)(H4,7,8,10)
InChIKey OCSQJDAUOOHJEI-UHFFFAOYSA-N
Mol Weight 188.57 g/mol
Molecular Formula C5H5ClN4O2
Exact Mass 188.010103 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JhShbvfZVKN
Name 3,5-Diamino-6-chloro-pyrazine-2-carboxylic acid
CAS Registry Number 4878-36-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H5ClN4O2
InChI InChI=1S/C5H5ClN4O2/c6-2-4(8)10-3(7)1(9-2)5(11)12/h(H,11,12)(H4,7,8,10)
InChIKey OCSQJDAUOOHJEI-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference R.L. Smith, D.W. Cochran, P.Gund, J. Am. Chem. Soc. 101, 191 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6