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METHYL-3',5'-DIAMINO-6'-CHLOR-PYRAZINE-CARBOXYLATE
SpectraBase Compound ID HgxTRFoPyIW
InChI InChI=1S/C6H7ClN4O2/c1-13-6(12)2-4(8)11-5(9)3(7)10-2/h1H3,(H4,8,9,11)
InChIKey KOOBYHRLTYIPTH-UHFFFAOYSA-N
Mol Weight 202.6 g/mol
Molecular Formula C6H7ClN4O2
Exact Mass 202.025753 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4w4LrHRERus
Name 3,5-Diamino-6-chloro-pyrazine-2-carboxylic acid, methyl ester
CAS Registry Number 1458-01-1
Comments SHIFTCORRECTION: +1.0 PPM (FROM SHUTSKE)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H7ClN4O2
InChI InChI=1S/C6H7ClN4O2/c1-13-6(12)2-4(8)11-5(9)3(7)10-2/h1H3,(H4,8,9,11)
InChIKey KOOBYHRLTYIPTH-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