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2-(3-chloro-2-keto-pyrazin-1-yl)acetic acid ethyl ester
SpectraBase Compound ID GvHSjXHrdl6
InChI InChI=1S/C8H9ClN2O3/c1-2-14-6(12)5-11-4-3-10-7(9)8(11)13/h3-4H,2,5H2,1H3
InChIKey XXDGQFANXYGUKC-UHFFFAOYSA-N
Mol Weight 216.62 g/mol
Molecular Formula C8H9ClN2O3
Exact Mass 216.03017 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EczxbUElhX6
Name 2-(3-chloro-2-keto-pyrazin-1-yl)acetic acid ethyl ester
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9ClN2O3
InChI InChI=1S/C8H9ClN2O3/c1-2-14-6(12)5-11-4-3-10-7(9)8(11)13/h3-4H,2,5H2,1H3
InChIKey XXDGQFANXYGUKC-UHFFFAOYSA-N
Literature Reference Author J.Y.CHUNG,R.J.CVETOVICH,F.R.TSAY,P.G.DORMER,L.DIMICHELE,D.J. MATHRE,J.R.CHILENSKI
Literature Reference Citation J.ORG.CHEM.,68,8838(2003)
Literature Reference DOI 10.1021/jo034835e
Molecular Weight 216.624 g/mol
Solvent CDCl3
Source File Reference UWSI21060