Determination of magnitudes and relative signs of 1H-19F coupling constants through 1D- and 2D-TOCSY experiments

J Org Chem. 2013 Dec 20;78(24):12844-7. doi: 10.1021/jo402344y. Epub 2013 Nov 15.

Abstract

A novel methodology based on 1D- and 2D-TOCSY experiments is described for a quick and accurate measurement of proton-fluorine coupling constants in fluorinated organic compounds. The magnitude of the (1)H-(19)F coupling was measured from the displacement between the relayed peaks associated with the α or β spin state of the fluorine, and its relative sign was derived from the sense of the displacement.

MeSH terms

  • Fluorine / chemistry*
  • Hydrocarbons, Fluorinated / chemistry*
  • Magnetic Resonance Spectroscopy / methods*
  • Molecular Structure
  • Protons

Substances

  • Hydrocarbons, Fluorinated
  • Protons
  • Fluorine