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3,4-BIS-(4-CHLOROPHENYL)-5-CYANO-4,7-DIHYDRO-6-PHENYL-2H-PYRAZOLO-[3,4-B]-PYRIDINE
SpectraBase Compound ID DYKA06GEHjc
InChI InChI=1S/C25H16Cl2N4/c26-18-10-6-15(7-11-18)21-20(14-28)23(16-4-2-1-3-5-16)29-25-22(21)24(30-31-25)17-8-12-19(27)13-9-17/h1-13,21H,(H2,29,30,31)
InChIKey MTBBLVYXNWTTIZ-UHFFFAOYSA-N
Mol Weight 443.34 g/mol
Molecular Formula C25H16Cl2N4
Exact Mass 442.075202 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FhNrLyvrfak
Name 3,4-BIS-(4-CHLOROPHENYL)-5-CYANO-4,7-DIHYDRO-6-PHENYL-2H-PYRAZOLO-[3,4-B]-PYRIDINE
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H16Cl2N4
InChI InChI=1S/C25H16Cl2N4/c26-18-10-6-15(7-11-18)21-20(14-28)23(16-4-2-1-3-5-16)29-25-22(21)24(30-31-25)17-8-12-19(27)13-9-17/h1-13,21H,(H2,29,30,31)
InChIKey MTBBLVYXNWTTIZ-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 443.335 g/mol
Solvent DMSO-D6
Source File Reference UWLU20920