Enhanced selectivity for acidic contaminants in drinking water: From suspect screening to toxicity prediction
File(s)D Ciccarelli HAZMAT 2023 NTA.pdf (2.58 MB)
Published version
Author(s)
Ciccarelli, Davide
Christopher Braddock, D
Surman, Andrew J
Arenas, Blanca Ivonne Vergara
Salal, Tara
Type
Journal Article
Abstract
A novel analytical workflow for suspect screening of organic acidic contaminants in drinking water is presented, featuring selective extraction by silica-based strong anion-exchange solid-phase extraction, mixed-mode liquid chromatography-high resolution accurate mass spectrometry (LC-HRMS), peak detection, feature reduction and compound identification. The novel use of an ammonium bicarbonate-based elution solvent extended strong anion-exchange solid-phase extraction applicability to LC-HRMS of strong acids. This approach performed with consistently higher recovery and repeatability (88 ± 7 % at 500 ng L-1), improved selectivity and lower matrix interference (mean = 12 %) over a generic mixed-mode weak anion exchange SPE method. In addition, a novel filter for reducing full-scan features from fulvic and humic acids was successfully introduced, reducing workload and potential for false positives. The workflow was then applied to 10 London municipal drinking water samples, revealing the presence of 22 confirmed and 37 tentatively identified substances. Several poorly investigated and potentially harmful compounds were found which included halogenated hydroxy-cyclopentene-diones and dibromomethanesulfonic acid. Some of these compounds have been reported as mutagenic in test systems and thus their presence here requires further investigation. Overall, this approach demonstrated that employing selective extraction improved detection and helped shortlist suspects and potentially toxic chemical contaminants with higher confidence.
Date Issued
2023-04
Date Acceptance
2023-01-28
Citation
Journal of Hazardous Materials, 2023, 448, pp.1-12
ISSN
0304-3894
Publisher
Elsevier BV
Start Page
1
End Page
12
Journal / Book Title
Journal of Hazardous Materials
Volume
448
Copyright Statement
© 2023 The Authors. Published by Elsevier B.V. This is an open access article under the CC BY license (http://creativecommons.org/licenses/by/4.0/).
License URL
Identifier
https://www.sciencedirect.com/science/article/pii/S0304389423001887?via%3Dihub
Publication Status
Published
Article Number
130906
Date Publish Online
2023-01-31