Enhancing both the Intensities and Resolution of <sup>19</sup> F NMR Spectra of PFAS through Band-Selective Homonuclear Decoupling

A method for acquiring fluorine nuclear magnetic resonance (<sup>19</sup>F NMR) spectra of perfluoroalkyl and polyfluoroalkyl substances (PFASs) is described. The experiment uses band-selective homonuclear decoupling of the CF<sub>3</sub> spectral region (around -82.4 ppm) and results in spectra showing both enhanced resolution and enhanced signal intensities for perfluorinated compounds. PFAS mixtures, which show highly overlapped multiplet signals in conventional <sup>19</sup>F NMR spectra, are reduced to individual separated singlets, enabling not only their identification but also quantification, which does not depend on the chemical nature of each compound.

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Publication Details

Journal
Analytical Chemistry
Published
2026-01-27
DOI
https://doi.org/10.1021/acs.analchem.5c05889
Primary Topic
Per- and polyfluoroalkyl substances research
Type
article
Field-Weighted Citation Impact
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article

Enhancing both the Intensities and Resolution of 19 F NMR Spectra of PFAS through Band-Selective Homonuclear Decoupling

Viktoria Müller, Armin Macher, Jörg Feldmann, Klaus Zangger et al.
Analytical Chemistry
Per- and polyfluoroalkyl substances research
article

Enhancing both the Intensities and Resolution of 19 F NMR Spectra of PFAS through Band-Selective Homonuclear Decoupling

Viktoria Müller, Armin Macher, Jörg Feldmann, Klaus Zangger, Markus Rotzinger
article en

Abstract

A method for acquiring fluorine nuclear magnetic resonance (<sup>19</sup>F NMR) spectra of perfluoroalkyl and polyfluoroalkyl substances (PFASs) is described. The experiment uses band-selective homonuclear decoupling of the CF<sub>3</sub> spectral region (around -82.4 ppm) and results in spectra showing both enhanced resolution and enhanced signal intensities for perfluorinated compounds. PFAS mixtures, which show highly overlapped multiplet signals in conventional <sup>19</sup>F NMR spectra, are reduced to individual separated singlets, enabling not only their identification but also quantification, which does not depend on the chemical nature of each compound.

Analytical ChemistryVol. 98(5)
James Hutton Institute (GB), University of Graz (AT)
Openalex Percentile: Top 78%
Per- and polyfluoroalkyl substances research
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Enhancing both the Intensities and Resolution of <sup>19</sup> F NMR Spectra of PFAS through Band-Selective Homonuclear Decoupling — Viktoria Müller, Armin Macher, et al. · Analytical Chemistry (2026) | TGRS Research Map | TGRS