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High Molecular Weight Spectral Interferences in Mass Spectra of Dissolved Organic Matter

[Image: see text] In this paper we investigate interferences that appear in molecular mass spectra from aquatic samples. The interferences are identified as doubly charged ions originating from high molecular weight material, which is especially abundant in terrestrial samples. The interferences cou...

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Autores principales: Patriarca, Claudia, Hawkes, Jeffrey A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2020
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7791554/
https://www.ncbi.nlm.nih.gov/pubmed/33232162
http://dx.doi.org/10.1021/jasms.0c00353
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author Patriarca, Claudia
Hawkes, Jeffrey A.
author_facet Patriarca, Claudia
Hawkes, Jeffrey A.
author_sort Patriarca, Claudia
collection PubMed
description [Image: see text] In this paper we investigate interferences that appear in molecular mass spectra from aquatic samples. The interferences are identified as doubly charged ions originating from high molecular weight material, which is especially abundant in terrestrial samples. The interferences could be incorrectly assigned to singly charged formulas with high aromaticity and heteroatom content, as the mass error from such formulas can be less than 1 ppm. We propose a strategy for filtering the interference peaks from mass lists based on the presence of their equivalent isotopologue peaks at mass defects of ∼0.5 Da.
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spelling pubmed-77915542021-01-11 High Molecular Weight Spectral Interferences in Mass Spectra of Dissolved Organic Matter Patriarca, Claudia Hawkes, Jeffrey A. J Am Soc Mass Spectrom [Image: see text] In this paper we investigate interferences that appear in molecular mass spectra from aquatic samples. The interferences are identified as doubly charged ions originating from high molecular weight material, which is especially abundant in terrestrial samples. The interferences could be incorrectly assigned to singly charged formulas with high aromaticity and heteroatom content, as the mass error from such formulas can be less than 1 ppm. We propose a strategy for filtering the interference peaks from mass lists based on the presence of their equivalent isotopologue peaks at mass defects of ∼0.5 Da. American Chemical Society 2020-11-24 2021-01-06 /pmc/articles/PMC7791554/ /pubmed/33232162 http://dx.doi.org/10.1021/jasms.0c00353 Text en © 2020 American Society for Mass Spectrometry. Published by American Chemical Society. All rights reserved. This is an open access article published under a Creative Commons Attribution (CC-BY) License (http://pubs.acs.org/page/policy/authorchoice_ccby_termsofuse.html) , which permits unrestricted use, distribution and reproduction in any medium, provided the author and source are cited.
spellingShingle Patriarca, Claudia
Hawkes, Jeffrey A.
High Molecular Weight Spectral Interferences in Mass Spectra of Dissolved Organic Matter
title High Molecular Weight Spectral Interferences in Mass Spectra of Dissolved Organic Matter
title_full High Molecular Weight Spectral Interferences in Mass Spectra of Dissolved Organic Matter
title_fullStr High Molecular Weight Spectral Interferences in Mass Spectra of Dissolved Organic Matter
title_full_unstemmed High Molecular Weight Spectral Interferences in Mass Spectra of Dissolved Organic Matter
title_short High Molecular Weight Spectral Interferences in Mass Spectra of Dissolved Organic Matter
title_sort high molecular weight spectral interferences in mass spectra of dissolved organic matter
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7791554/
https://www.ncbi.nlm.nih.gov/pubmed/33232162
http://dx.doi.org/10.1021/jasms.0c00353
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