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N'-[3-(1-HYDROXY-4-TERT.-BUTYLCYCLOHEXYL)-4-METHOXYPHENYL]-N-[(1-HYDROXY-4-TERT.-BUTYLCYCLOHEXYL)-METHYL]-N-METHYLUREA
SpectraBase Compound ID 1aWdcXUjyZD
InChI InChI=1S/C30H50N2O4/c1-27(2,3)21-11-15-29(34,16-12-21)20-32(7)26(33)31-23-9-10-25(36-8)24(19-23)30(35)17-13-22(14-18-30)28(4,5)6/h9-10,19,21-22,34-35H,11-18,20H2,1-8H3,(H,31,33)
InChIKey GOLDWEMZAQWHMW-UHFFFAOYSA-N
Mol Weight 502.7 g/mol
Molecular Formula C30H50N2O4
Exact Mass 502.377058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CzCMnvQUsIv
Name N'-[3-(1-HYDROXY-4-TERT.-BUTYLCYCLOHEXYL)-4-METHOXYPHENYL]-N-[(1-HYDROXY-4-TERT.-BUTYLCYCLOHEXYL)-METHYL]-N-METHYLUREA
Compound Number 42
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50N2O4
InChI InChI=1S/C30H50N2O4/c1-27(2,3)21-11-15-29(34,16-12-21)20-32(7)26(33)31-23-9-10-25(36-8)24(19-23)30(35)17-13-22(14-18-30)28(4,5)6/h9-10,19,21-22,34-35H,11-18,20H2,1-8H3,(H,31,33)
InChIKey GOLDWEMZAQWHMW-UHFFFAOYSA-N
Literature Reference Author K.SMITH,G.A.EL-HITI,A.P.SHUKLA
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2305(1999)
Literature Reference DOI 10.1039/a903464a
Molecular Weight 502.738 g/mol
Solvent CDCl3
Source File Reference UWGE3579