Characterization of Anticancer Drug Protomers Using Electrospray Ionization and Ion Mobility Spectrometry–Mass Spectrometry

We used electrospray ionization and ion mobility spectrometry-mass spectrometry to detect and characterize the three anticancer drugs palbociclib, copanlisib, and olaparib. Ion mobility-mass spectrometry and density functional theory revealed that these compounds generate isomers during ionization (protomers) due to the presence of multiple protonation sites within their chemical structures. Our work has implications for understanding the solution- and gas-phase chemistry of these molecules during spray-based ionization processes.

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Publication Details

Journal
Journal of the American Society for Mass Spectrometry
Published
2024-09-27
DOI
https://doi.org/10.1021/jasms.4c00233
Citations
5
Primary Topic
Mass Spectrometry Techniques and Applications
Type
article
Field-Weighted Citation Impact
1.20

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article

Characterization of Anticancer Drug Protomers Using Electrospray Ionization and Ion Mobility Spectrometry–Mass Spectrometry

Pascal Schorr, Dietrich A. Volmer, Kevin Pagel, Jerome Riedel et al.
5 citations
Journal of the American Society for Mass Spectrometry
Mass Spectrometry Techniques and Applications
1.20
article

Characterization of Anticancer Drug Protomers Using Electrospray Ionization and Ion Mobility Spectrometry–Mass Spectrometry

Pascal Schorr, Dietrich A. Volmer, Kevin Pagel, Jerome Riedel, Borislav Kovačević, Pallab Basuri, Marc Safferthal
article en
5 citations

Abstract

We used electrospray ionization and ion mobility spectrometry-mass spectrometry to detect and characterize the three anticancer drugs palbociclib, copanlisib, and olaparib. Ion mobility-mass spectrometry and density functional theory revealed that these compounds generate isomers during ionization (protomers) due to the presence of multiple protonation sites within their chemical structures. Our work has implications for understanding the solution- and gas-phase chemistry of these molecules during spray-based ionization processes.

Journal of the American Society for Mass SpectrometryVol. 35(12)
Humboldt-Universität zu Berlin (DE), Ruđer Bošković Institute (HR), Freie Universität Berlin (DE)
Deutsche Forschungsgemeinschaft, Bundesministerium für Bildung und Forschung, Max-Planck-Gesellschaft
Openalex Percentile: Top 23%
Mass Spectrometry Techniques and Applications
1.20
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