Conformational equilibria of (E)-6-bromo-7-hydroxy-3,7-dimethyl-2-octene

M.E. van Dommelen, L.J.M. Ven, van de, H.M. Buck, J.W. Haan, de

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Abstract

The 1H NMR spectral parameters of the title compound have been determined in cyclohexane-d12 and p-dioxane-d8 solutions by means of high-frequency NMR. The results are interpreted in terms of conformational equilibria. Linear Electric Field (LEF) effects may play a major role in explaining the differences between the 13C NMR chemical shifts of the title compound and those of the model (E)2,6-dimethyl-2,6-octadiene. Some preliminary calculations of the LEF-induced shifts are presented, as well as the problems involved in the recognition of the LEF contributions to the experimental shift differences.
Original languageEnglish
Pages (from-to)180-184
JournalRecueil des Travaux Chimiques des Pays-Bas
Volume100
Issue number5
DOIs
Publication statusPublished - 1981

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