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3-(2-BENZYLOXY-4,6-DICHLOROPHENYL)-5-(2,4-DICHLOROPHENYL)-1-DODECYL-PYRAZOLE
SpectraBase Compound ID E4hDrIzyk3M
InChI InChI=1S/C34H38Cl4N2O/c1-2-3-4-5-6-7-8-9-10-14-19-40-32(28-18-17-26(35)20-29(28)37)23-31(39-40)34-30(38)21-27(36)22-33(34)41-24-25-15-12-11-13-16-25/h11-13,15-18,20-23H,2-10,14,19,24H2,1H3
InChIKey SEBSRENDXQRTHW-UHFFFAOYSA-N
Mol Weight 632.5 g/mol
Molecular Formula C34H38Cl4N2O
Exact Mass 630.173825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AGM5EyhxZ3s
Name 3-(2-BENZYLOXY-4,6-DICHLOROPHENYL)-5-(2,4-DICHLOROPHENYL)-1-DODECYL-PYRAZOLE
Compound Number 11D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H38Cl4N2O
InChI InChI=1S/C34H38Cl4N2O/c1-2-3-4-5-6-7-8-9-10-14-19-40-32(28-18-17-26(35)20-29(28)37)23-31(39-40)34-30(38)21-27(36)22-33(34)41-24-25-15-12-11-13-16-25/h11-13,15-18,20-23H,2-10,14,19,24H2,1H3
InChIKey SEBSRENDXQRTHW-UHFFFAOYSA-N
Literature Reference Author V.L.M.SILVA,A.M.S.SILVA,D.C.G.A.PINTO,N.JAGEROVIC,L.F.CALLAD O,J.A.S.CAVALEIRO,J.
Literature Reference Citation MH.CHEM.,138,797(2007)
Literature Reference DOI 10.1007/s00706-007-0676-4
Molecular Weight 632.501 g/mol
Sample ID 68607
Solvent CDCl3