Login / Signup

Separating the coherence transfer from chemical shift evolution in high-resolution pure shift COSY NMR.

Juan A AguilarRaquel BeldaBenjamin R GauntAlan M KenwrightIlya Kuprov
Published in: Magnetic resonance in chemistry : MRC (2018)
Recent developments in data sampling and processing techniques have made it possible to acquire 2-dimensional NMR spectra of small molecules at digital resolutions in both dimensions approaching the intrinsic limitations of the equipment and sample on a realistic timescale. These developments offer the possibility of enormously increased effective resolution (peak dispersion) and the ability to effectively study samples where peak overlap was previously a limiting factor. Examples of such spectra have been produced for a number of 2-dimensional techniques including TOCSY and HSQC. In this paper, we investigate some of the problems in applying such techniques to COSY spectra and suggest a modification to the classic experiment that alleviates some of these problems.
Keyphrases
  • high resolution
  • mental health
  • density functional theory
  • magnetic resonance
  • solid state
  • big data
  • single molecule
  • molecular dynamics
  • high speed
  • tandem mass spectrometry
  • artificial intelligence
  • data analysis