Computed chemical shifts and coupling constants for xanthone in deuteriochloroform and trifluoroacetic acid are in agreement with experimental data at 60,100, and 220 MHz. The increased dispersion of the signals a t 220 M H z in deuteriochloroform shows four distinct aromatic proton signals which can be analysed directly by first-order methods. Fundamental parameters for xanthone in carbon tetrachloride, pentadeuteriopyridine, hexadeuterioacetone, and hexadeuteriodimethyl sulphoxide have also been measured. Additive diamagnetic shifts for urtho-, meta-, and para-hydroxy-, alkoxy-, and alkyl substituents have been determined empirically and experimental and predicted chemical-shifts for natural and synthetic xanthones are in agreement, providing steric hindrance of vicinal groups is considered. The influence of been correlated.
scite is a Brooklyn-based organization that helps researchers better discover and understand research articles through Smart Citations–citations that display the context of the citation and describe whether the article provides supporting or contrasting evidence. scite is used by students and researchers from around the world and is funded in part by the National Science Foundation and the National Institute on Drug Abuse of the National Institutes of Health.