NMR Spectral Chromatography: A Powerful New Tool for Structure Determination.

Abstract

A new technique is described which radically simplified complex nuclear magnetic resonance spectra and markedly increases their information content. Through the use of a unique chemical additive in a sample solution, overlapping spectral peaks are separated, coincidental resonances are dispersed and the entire spectrum remarkably simplified as a result of induced spectral shifts. The additive is a fluorinated rare earth chelate, Eu(fod)3, which is believed to represent the optimum combination of lanthanide metal and organic ligand for use as a shift reagent. Its effect on an NMR spectrum is to 'chromatograph' it by causing spectral absorptions to move to different extents along the 'spectral chromatogram'. The value of 'NMR Spectral Chromatography' is demonstrated by the analysis of a number of complex, misleading and, in some cases, unresolvable spectra. Useful relationships between molecular structure and shifting patterns are pointed out and used in making structural assignments. (Author)

Document Details

Document Type
Technical Report
Publication Date
Jan 01, 1972
Accession Number
AD0739885

Entities

People

  • Martin A. Berwick
  • Roger E. Rondeau

Organizations

  • Air Force Research Laboratory

Tags

DTIC Thesaurus Topics

  • Absorption
  • Additives (Chemicals)
  • Chromatographs
  • Chromatography
  • Magnetic Resonance
  • Metals
  • Molecular Structure
  • Motion
  • Nuclear Magnetic Resonance
  • Resonance
  • Spectra

Fields of Study

  • Chemistry

Readers

  • Analytical Chemistry
  • Quantum spin resonance or Electron Paramagnetic Resonance spectroscopy.
  • Regression Analysis.