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Automated fragment formula annotation for electron ionisation, high resolution mass spectrometry: application to atmospheric measurements of halocarbons

BACKGROUND: Non-target screening consists in searching a sample for all present substances, suspected or unknown, with very little prior knowledge about the sample. This approach has been introduced more than a decade ago in the field of water analysis, together with dedicated compound identificatio...

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Detalles Bibliográficos
Autores principales: Guillevic, Myriam, Guillevic, Aurore, Vollmer, Martin K., Schlauri, Paul, Hill, Matthias, Emmenegger, Lukas, Reimann, Stefan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8491408/
https://www.ncbi.nlm.nih.gov/pubmed/34607604
http://dx.doi.org/10.1186/s13321-021-00544-w