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1-(4-CHLOROPHENYL)-3-(5-HYDROXYNAPHTHO-[1,2-B]-FURAN-3-CARBONYL)-1H-PYRAZOLE-4-CARBONITRILE
SpectraBase Compound ID CvDgOIZRiyB
InChI InChI=1S/C23H12ClN3O3/c24-14-5-7-15(8-6-14)27-11-13(10-25)21(26-27)22(29)19-12-30-23-17-4-2-1-3-16(17)20(28)9-18(19)23/h1-9,11-12,28H
InChIKey QXSCSNOTUATDLH-UHFFFAOYSA-N
Mol Weight 413.82 g/mol
Molecular Formula C23H12ClN3O3
Exact Mass 413.056719 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgRBEynM52E
Name 1-(4-CHLOROPHENYL)-3-(5-HYDROXYNAPHTHO-[1,2-B]-FURAN-3-CARBONYL)-1H-PYRAZOLE-4-CARBONITRILE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H12ClN3O3
InChI InChI=1S/C23H12ClN3O3/c24-14-5-7-15(8-6-14)27-11-13(10-25)21(26-27)22(29)19-12-30-23-17-4-2-1-3-16(17)20(28)9-18(19)23/h1-9,11-12,28H
InChIKey QXSCSNOTUATDLH-UHFFFAOYSA-N
Literature Reference Author S.A.S.GHOZLAN,I.A.ABDELHAMID,H.M.GABER,M.H.ELNAGDI
Literature Reference Citation J.HETCYCL.CHEM.,42,1185(2005)
Literature Reference DOI 10.1002/jhet.5570420623
Molecular Weight 413.820 g/mol
Sample ID 42246
Solvent DMSO-D6