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5-(4-CHLOROPHENYL)-1-(2,4-DICHLOROPHENYL)-3-CYCLOHEXYL-1H-1,2,4-TRIAZOLE
SpectraBase Compound ID 6AF089a16y5
InChI InChI=1S/C20H18Cl3N3/c21-15-8-6-14(7-9-15)20-24-19(13-4-2-1-3-5-13)25-26(20)18-11-10-16(22)12-17(18)23/h6-13H,1-5H2
InChIKey XRBWPEKGWCXPLQ-UHFFFAOYSA-N
Mol Weight 406.74 g/mol
Molecular Formula C20H18Cl3N3
Exact Mass 405.056631 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F1jy5YP0MI9
Name 5-(4-CHLOROPHENYL)-1-(2,4-DICHLOROPHENYL)-3-CYCLOHEXYL-1H-1,2,4-TRIAZOLE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18Cl3N3
InChI InChI=1S/C20H18Cl3N3/c21-15-8-6-14(7-9-15)20-24-19(13-4-2-1-3-5-13)25-26(20)18-11-10-16(22)12-17(18)23/h6-13H,1-5H2
InChIKey XRBWPEKGWCXPLQ-UHFFFAOYSA-N
Literature Reference Author L.HERNANDEZ-FOLGADO,P.GOYA,J.FRIGOLA,M.R.CUBERES,A.DORDAL,J. HOLENZ,N.JAGEROVIC
Literature Reference Citation MH.CHEM.,139,1073(2008)
Literature Reference DOI 10.1007/s00706-008-0890-8
Molecular Weight 406.742 g/mol
Sample ID 40057
Solvent CDCl3