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3-AMINO-6-CHLORO-5-(ISOPROPYLAMINO)PYRAZINECARBOXYLIC ACID, METHYLESTER
SpectraBase Compound ID LEXa59jVVND
InChI InChI=1S/C9H13ClN4O2/c1-4(2)12-8-6(10)13-5(7(11)14-8)9(15)16-3/h4H,1-3H3,(H3,11,12,14)
InChIKey QGQKHPYCZAYLKB-UHFFFAOYSA-N
Mol Weight 244.68 g/mol
Molecular Formula C9H13ClN4O2
Exact Mass 244.072703 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B8hf1ghFmMi
Name 3-AMINO-6-CHLORO-5-(ISOPROPYLAMINO)PYRAZINECARBOXYLIC ACID, METHYLESTER
Source of Sample R. L. Smith, D. W. Cochran, P. Gund J. Amer. Chem. Soc. 101, 191(1979)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13ClN4O2
InChI InChI=1S/C9H13ClN4O2/c1-4(2)12-8-6(10)13-5(7(11)14-8)9(15)16-3/h4H,1-3H3,(H3,11,12,14)
InChIKey QGQKHPYCZAYLKB-UHFFFAOYSA-N
Molecular Weight 244.68
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Varian CFT-20
Synonyms PYRAZINECARBOXYLIC ACID, 3-AMINO- 6-CHLORO-5-/ISOPROPYLAMINO/-, METHYL ESTER