Automatic Assignment of Molecular Ion Species to Elemental Formulas in Gas Chromatography/Methane Chemical Ionization Accurate Mass Spectrometry

Gas chromatography–mass spectrometry (GC-MS) usually employs hard electron ionization, leading to extensive fragmentations that are suitable to identify compounds based on library matches. However, such spectra are less useful to structurally characterize unknown compounds that are absent from libra...

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Detalles Bibliográficos
Autores principales: Wang, Shunyang, Valdiviez, Luis, Ye, Honglian, Fiehn, Oliver
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Technical Note
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10456597/
https://www.ncbi.nlm.nih.gov/pubmed/37623905
http://dx.doi.org/10.3390/metabo13080962

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10456597/
https://www.ncbi.nlm.nih.gov/pubmed/37623905
http://dx.doi.org/10.3390/metabo13080962

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