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NMR methods for the analysis of mixtures

Jean‐Nicolas Dumez

2022Chemical Communications43 citationsDOIOpen Access PDF

Abstract

NMR spectroscopy is a powerful approach for the analysis of mixtures. Its usefulness arises in large part from the vast landscape of methods, and corresponding pulse sequences, that have been and are being designed to tackle the specific properties of mixtures of small molecules. This feature article describes a selection of methods that aim to address the complexity, the low concentrations, and the changing nature that mixtures can display. These notably include pure-shift and diffusion NMR methods, hyperpolarisation methods, and fast 2D NMR methods such as ultrafast 2D NMR and non-uniform sampling. Examples or applications are also described, in fields such as reaction monitoring and metabolomics, to illustrate the relevance and limitations of different methods.

Topics & Concepts

Selection (genetic algorithm)Nuclear magnetic resonance spectroscopyFeature selectionFeature (linguistics)Computer scienceChemistryArtificial intelligenceOrganic chemistryPhilosophyLinguisticsAdvanced NMR Techniques and ApplicationsNMR spectroscopy and applicationsAdvanced MRI Techniques and Applications
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