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- Title
Supporting the assignment of NMR spectra with variable‐temperature experiments.
- Authors
Nawrocka, Ewa K.; Jadwiszczak, Michał; Leszczyński, Piotr J.; Kazimierczuk, Krzysztof
- Abstract
Nuclear magnetic resonance (NMR) spectroscopy is one of the most powerful tools in analytical chemistry. An important step in the analysis of NMR data is the assignment of resonance frequencies to the corresponding atoms in the molecule being investigated. The traditional approach considers the spectrum's characteristic parameters: chemical shift values, internuclear couplings, and peak intensities. In this paper, we show how to support the process of assigning a series of spectra of similar organic compounds by using temperature coefficients, that is, the rates of change in chemical shift values associated with given changes in temperature.
- Subjects
NUCLEAR magnetic resonance spectroscopy; NUCLEAR magnetic resonance; ANALYTICAL chemistry
- Publication
Magnetic Resonance in Chemistry, 2024, Vol 62, Issue 7, p479
- ISSN
0749-1581
- Publication type
Article
- DOI
10.1002/mrc.5433