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Journal ArticleDOI

Nuclear Magnetic Resonance Spectroscopy. Carbon-13 Chemical Shifts in Acyclic and Alicyclic Alcohols

TLDR
In this article, the chemical shifts of a variety of acyclic and alicyclic alcohols have been determined by high resolution spectroscopy with the aid of proton decoupling.
Abstract
The chemical shifts of ^(13)C in a variety of acyclic and alicyclic alcohols have been determined by high resolution nmr spectroscopy with the aid of proton decoupling It has been found that there are rather good linear relationships between carbon chemical shifts in alcohols and analogously constituted hydrocarbons, wherein a methyl group replaces the hydroxyl group The linear correlation coefficients for relationships of the general type δ_CROH = Aδ_CRCHa + B are better than 098 for shifts of corresponding ɑ (directly attached hydroxyl), β, y, and δ carbons for a variety of primary, secondary, and tertiary acyclic alcohols and cyclohexanols carrying both axial and equatorial substituents The shifts of the carbons of a number of cycloalkanols have been investigated in hope of providing information about conformations in medium-sized ring compounds

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Journal ArticleDOI

CH/π interaction: Implications in organic chemistry

TL;DR: In this article, a weak hydrogen-bond-like interaction, known as the CH/π interaction, was proposed to understand the conformational behaviors of organic molecules. But it was not shown to be a strong interaction.
Journal ArticleDOI

Theoretical and empirical calculations of the carbon chemical shift in terms of the electronic distribution in molecules

TL;DR: In this paper, the principles of the theoretical calculations of the carbon atom screening constant are reviewed, and various empirical correlations which make an evaluation of δ13C from structural and physical properties possible are shown.
Journal ArticleDOI

Preparation of Neutral Ionophores for Alkali and Alkaline Earth Metal Cations and their application in ion selective membrane electrodes

TL;DR: The preparation of a series of non-cyclic, uncharged ligands able to selectively complex alkali and alkaline earth metal cations is described, which show high Ca2+ and Na+ selectivity in liquid membrane electrodes.
Journal ArticleDOI

Calculation of dipolar nuclear magnetic relaxation times in molecules with multiple internal rotations. II. Theoretical results for anisotropic over‐all motion of the molecule, and comparison with 13C relaxation times in n ‐alkanes and n ‐alkyl bromides

TL;DR: The theory of dipolar nuclear magnetic relaxation in molecules with multiple internal motions is extended to the case where the motion of the molecule as a whole is anisotropic, with no restriction on the magnitudes of the correlation times involved as discussed by the authors.
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