Slice through the water-Exploring the fundamental challenge of water suppression for benchtop NMR systems

Benchtop NMR provides improved accessibility in terms of cost, space, and technical expertise. In turn, this encourages new users into the field of NMR spectroscopy. Unfortunately, many interesting samples in education and research, from beer to whole blood, contain significant amounts of water that...

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Veröffentlicht in:Magnetic resonance in chemistry 2024-06, Vol.62 (6), p.463-473
Hauptverfasser: Pellizzari, Jacob, Soong, Ronald, Downey, Katelyn, Biswas, Rajshree Ghosh, Kock, Flavio C, Steiner, Katrina, Goerling, Benjamin, Haber, Agnes, Decker, Venita, Busse, Falko, Simpson, Myrna, Simpson, Andre
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container_end_page 473
container_issue 6
container_start_page 463
container_title Magnetic resonance in chemistry
container_volume 62
creator Pellizzari, Jacob
Soong, Ronald
Downey, Katelyn
Biswas, Rajshree Ghosh
Kock, Flavio C
Steiner, Katrina
Goerling, Benjamin
Haber, Agnes
Decker, Venita
Busse, Falko
Simpson, Myrna
Simpson, Andre
description Benchtop NMR provides improved accessibility in terms of cost, space, and technical expertise. In turn, this encourages new users into the field of NMR spectroscopy. Unfortunately, many interesting samples in education and research, from beer to whole blood, contain significant amounts of water that require suppression in H NMR in order to recover sample information. However, due to the significant reduction in chemical shift dispersion in benchtop NMR systems, the sample signals are much closer to the water resonance compared to those in a corresponding high-field NMR spectrum. Therefore, simply translating solvent suppression experiments intended for high-field NMR instruments to benchtop NMR systems without careful consideration can be problematic. In this study, the effectiveness of several popular water suppression schemes was evaluated for benchtop NMR applications. Emphasis is placed on pulse sequences with no, or few, adjustable parameters making them easy to implement. These fall into two main categories: (1) those based on Pre-SAT including Pre-SAT, PURGE, NOESY-PR, and g-NOESY-PR and (2) those based on binomial inversion including JRS and W5-WATERGATE. Among these schemes, solvent suppression sequences based on Pre-SAT offer a general approach for easy solvent suppression for samples with higher analyte concentrations (sucrose standard and Redbull™). However, for human urine, binomial-like sequences were required. In summary, it is demonstrated that highly efficient water suppression approaches can be implemented on benchtop NMR systems in a simple manner, despite the limited spectral dispersion, further illustrating the potential for widespread implementation of these approaches in education and research.
doi_str_mv 10.1002/mrc.5431
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subjects Chemical equilibrium
Education
NMR spectroscopy
Solvents
System effectiveness
title Slice through the water-Exploring the fundamental challenge of water suppression for benchtop NMR systems
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