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5-AMINO-3-(PARA-CHLOROPHENYL)-4-CYANO-1-CYClOHEXYLPYRAZOLE
SpectraBase Compound ID 60wiA8fyMtr
InChI InChI=1S/C16H17ClN4/c17-12-8-6-11(7-9-12)15-14(10-18)16(19)21(20-15)13-4-2-1-3-5-13/h6-9,13H,1-5,19H2
InChIKey NVCVOXDSSBAWRX-UHFFFAOYSA-N
Mol Weight 300.79 g/mol
Molecular Formula C16H17ClN4
Exact Mass 300.114174 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HEChkE8nw5h
Name 5-AMINO-3-(PARA-CHLOROPHENYL)-4-CYANO-1-CYClOHEXYLPYRAZOLE
Compound Number 4G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17ClN4
InChI InChI=1S/C16H17ClN4/c17-12-8-6-11(7-9-12)15-14(10-18)16(19)21(20-15)13-4-2-1-3-5-13/h6-9,13H,1-5,19H2
InChIKey NVCVOXDSSBAWRX-UHFFFAOYSA-N
Literature Reference Author U.HANEFELD,C.W.REES,A.J.P.WHITE,D.J.WILLIAMS
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1545(1996)
Literature Reference DOI 10.1039/p19960001545
Molecular Weight 300.791 g/mol
Solvent DMSO-D6
Source File Reference WANG1755