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N-(4-CHLOROPHENYL)-3,7-DIMETHYL-4-OXO-4,6-DIHYDROPYRAZOLO-[5,1-C]-[1,2,4]-TRIAZINE-8-CARBOXAMIDE
SpectraBase Compound ID 5V2I7lRB1Nj
InChI InChI=1S/C14H12ClN5O2/c1-7-11(12-18-17-8(2)14(22)20(12)19-7)13(21)16-10-5-3-9(15)4-6-10/h3-6,19H,1-2H3,(H,16,21)
InChIKey JOMAHBBTEZBCEP-UHFFFAOYSA-N
Mol Weight 317.74 g/mol
Molecular Formula C14H12ClN5O2
Exact Mass 317.067952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1dZXBimpgoi
Name N-(4-CHLOROPHENYL)-3,7-DIMETHYL-4-OXO-4,6-DIHYDROPYRAZOLO-[5,1-C]-[1,2,4]-TRIAZINE-8-CARBOXAMIDE
Compound Number 3E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12ClN5O2
InChI InChI=1S/C14H12ClN5O2/c1-7-11(12-18-17-8(2)14(22)20(12)19-7)13(21)16-10-5-3-9(15)4-6-10/h3-6,19H,1-2H3,(H,16,21)
InChIKey JOMAHBBTEZBCEP-UHFFFAOYSA-N
Literature Reference Author A.A.EL-BARBARY,M.A.EL-BADAWI,Y.M.LOKSHA
Literature Reference Citation J.HETCYCL.CHEM.,38,711(2001)
Literature Reference DOI 10.1002/jhet.5570380328
Molecular Weight 317.735 g/mol
Solvent DMSO-D6
Source File Reference UWLU21260