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4-(4-CHLOROPHENYL)-5-CYANO-4,7-DIHYDRO-3-(4-METHYLPHENYL)-6-PHENYL-2H-PYRAZOLO-[3,4-B]-PYRIDINE
SpectraBase Compound ID 1tXtuKjToAI
InChI InChI=1S/C26H19ClN4/c1-16-7-9-19(10-8-16)25-23-22(17-11-13-20(27)14-12-17)21(15-28)24(29-26(23)31-30-25)18-5-3-2-4-6-18/h2-14,22H,1H3,(H2,29,30,31)
InChIKey CSAJHKDTJNHYDB-UHFFFAOYSA-N
Mol Weight 422.92 g/mol
Molecular Formula C26H19ClN4
Exact Mass 422.129824 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BZF3pEN7wzR
Name 4-(4-CHLOROPHENYL)-5-CYANO-4,7-DIHYDRO-3-(4-METHYLPHENYL)-6-PHENYL-2H-PYRAZOLO-[3,4-B]-PYRIDINE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H19ClN4
InChI InChI=1S/C26H19ClN4/c1-16-7-9-19(10-8-16)25-23-22(17-11-13-20(27)14-12-17)21(15-28)24(29-26(23)31-30-25)18-5-3-2-4-6-18/h2-14,22H,1H3,(H2,29,30,31)
InChIKey CSAJHKDTJNHYDB-UHFFFAOYSA-N
Literature Reference Author J.QUIROGA,S.CRUZ,B.INSUASTY,R.ABONIA,J.COBO,A.SANCHEZ,M.NOGU ERAS,J.N.LOW
Literature Reference Citation J.HETCYCL.CHEM.,38,53(2001)
Literature Reference DOI 10.1002/jhet.5570380108
Molecular Weight 422.917 g/mol
Solvent DMSO-D6
Source File Reference UWLU20918