1H chemical shifts in NMR: Part 22 - Prediction of the 1H chemical shifts of alcohols, diols and inositols in solution, a conformational and solvation investigation

Magnetic Resonance in Chemistry

Volumn 43, Issue 8, 2005, Pages 611-624

  Abraham, Raymond J ^a   Byrne, Jonathan J ^a   Griffiths, Lee ^b   Koniotou, Rodothea ^a  

^a UNIVERSITY OF LIVERPOOL   (United Kingdom)

^b ASTRAZENECA   (United Kingdom)

Author keywords

1H chemical shifts; 1H NMR; Alcohols; Conformational analysis; NMR; NMR prediction; Solvation

Indexed keywords

CHEMICAL SHIFT; CONFORMATIONS; FORECASTING; HYDROGEN BONDS; MAGNETIC ANISOTROPY; MOLECULES; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; POLYOLS; SOLVATION; SOLVENTS;

1H CHEMICAL SHIFT; 1H NMR; CONFORMATIONAL ANALYSIS; COUPLING CONSTANTS; H NMR SPECTRA; LONG RANGE EFFECTS; MYO-INOSITOL; NMR PREDICTION; OH-GROUPS; SPECIFIC SOLVATION;

ALCOHOLS;

ALCOHOL DERIVATIVE; DRUG DERIVATIVE; INOSITOL; PROTON;

ARTICLE; CHEMISTRY; CONFORMATION; METHODOLOGY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; SOLUBILITY; SOLUTION AND SOLUBILITY; STANDARD;

ALCOHOLS; INOSITOL; MAGNETIC RESONANCE SPECTROSCOPY; MOLECULAR CONFORMATION; PROTONS; SOLUBILITY; SOLUTIONS;

EID: 22244478023     PISSN: 07491581     EISSN: None     Source Type: Journal    
DOI: 10.1002/mrc.1611     Document Type: Article

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