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(1R/S,2S,5R)-2-ISOPROPYL-5-METHYLCYCLOHEXYL-1-(4'-METHOXYLBENZOATE)
SpectraBase Compound ID JyiJfgASRpo
InChI InChI=1S/C18H26O3/c1-12(2)16-10-5-13(3)11-17(16)21-18(19)14-6-8-15(20-4)9-7-14/h6-9,12-13,16-17H,5,10-11H2,1-4H3/t13-,16+,17?/m1/s1
InChIKey YILDRXMSKBSBHU-WBTZKQGOSA-N
Mol Weight 290.4 g/mol
Molecular Formula C18H26O3
Exact Mass 290.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID TsPVgRC3lM
Name (1R/S,2S,5R)-2-ISOPROPYL-5-METHYLCYCLOHEXYL-1-(4'-METHOXYLBENZOATE)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H26O3
InChI InChI=1S/C18H26O3/c1-12(2)16-10-5-13(3)11-17(16)21-18(19)14-6-8-15(20-4)9-7-14/h6-9,12-13,16-17H,5,10-11H2,1-4H3/t13-,16+,17?/m1/s1
InChIKey YILDRXMSKBSBHU-WBTZKQGOSA-N
Literature Reference Author J.MCNULTY,A.CAPRETTA,V.LARITCHEV,J.DYCK,A.J.ROBERTSON
Literature Reference Citation J.ORG.CHEM.,68,1597(2003)
Literature Reference DOI 10.1021/jo026639y
Molecular Weight 290.403 g/mol
Solvent CDCl3
Source File Reference UWVN25164