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1-(4-CHLOROPHENYL)-3-[1-(PHENYLHYDRAZONO)-ETHYL]-1H-PYRAZOLE-4-CARBONITRILE
SpectraBase Compound ID G13Hd1qqduW
InChI InChI=1S/C18H14ClN5/c1-13(21-22-16-5-3-2-4-6-16)18-14(11-20)12-24(23-18)17-9-7-15(19)8-10-17/h2-10,12,22H,1H3/b21-13+
InChIKey CMHXRZZXZDQQCQ-FYJGNVAPSA-N
Mol Weight 335.8 g/mol
Molecular Formula C18H14ClN5
Exact Mass 335.093773 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JCalGGfFnxG
Name 1-(4-CHLOROPHENYL)-3-[1-(PHENYLHYDRAZONO)-ETHYL]-1H-PYRAZOLE-4-CARBONITRILE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14ClN5
InChI InChI=1S/C18H14ClN5/c1-13(21-22-16-5-3-2-4-6-16)18-14(11-20)12-24(23-18)17-9-7-15(19)8-10-17/h2-10,12,22H,1H3/b21-13+
InChIKey CMHXRZZXZDQQCQ-FYJGNVAPSA-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 335.796 g/mol
Sample ID 42244
Solvent DMSO-D6