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DIETHYL-(5-AMINO-1-(6-CHLOROPYRIDIN-2-YL)-3-METHYLSULFANYL-1H-PYRAZOL-4-YL)-PHOSPHONATE
SpectraBase Compound ID EjHlAzy6xhO
InChI InChI=1S/C13H18ClN4O3PS/c1-4-20-22(19,21-5-2)11-12(15)18(17-13(11)23-3)10-8-6-7-9(14)16-10/h6-8H,4-5,15H2,1-3H3
InChIKey RJQZUOZHLZRWAS-UHFFFAOYSA-N
Mol Weight 376.8 g/mol
Molecular Formula C13H18ClN4O3PS
Exact Mass 376.052576 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID wQthiQdpDp
Name DIETHYL-(5-AMINO-1-(6-CHLOROPYRIDIN-2-YL)-3-METHYLSULFANYL-1H-PYRAZOL-4-YL)-PHOSPHONATE
Compound Number 5.1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18ClN4O3PS
InChI InChI=1S/C13H18ClN4O3PS/c1-4-20-22(19,21-5-2)11-12(15)18(17-13(11)23-3)10-8-6-7-9(14)16-10/h6-8H,4-5,15H2,1-3H3
InChIKey RJQZUOZHLZRWAS-UHFFFAOYSA-N
Literature Reference Author H.G.KRUG,R.NEIDLEIN,R.BOESE,W.KRAMER
Literature Reference Citation HETEROCYCLES,41,721(1995)
Literature Reference DOI 10.3987/COM-94-6976
Molecular Weight 376.798 g/mol
Solvent CDCl3
Source File Reference UWCP6064