Structural Studies of Monounsaturated and ω-3 Polyunsaturated Free Fatty Acids in Solution with the Combined Use οf NMR and DFT Calculations—Comparison with the Liquid State

Molecular structures, in chloroform and DMSO solution, of the free fatty acids (FFAs) caproleic acid, oleic acid, α-linolenic acid, eicosapentanoic acid (EPA) and docosahexaenoic acid (DHA) are reported with the combined use of NMR and DFT calculations. Variable temperature and concentration chemica...

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Autori principali:	Themistoklis Venianakis, Michael G. Siskos, George Papamokos, Ioannis P. Gerothanassis
Natura:	Artigo
Lingua:	Inglês
Pubblicazione:	MDPI AG 2023-08-01
Serie:	Molecules
Soggetti:	1D <sup>1</sup>H NOE <sup>1</sup>H NMR chemical shift ALA EPA DHA DFT
Accesso online:	https://www.mdpi.com/1420-3049/28/16/6144
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