Dimercaprol (BAL): Insights into conformational stability, fragmentation pathways via tandem LR-ESI, HR-EI mass spectrometry, and gas-phase thermochemical properties from quantum chemical calculations.

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Title: Dimercaprol (BAL): Insights into conformational stability, fragmentation pathways via tandem LR-ESI, HR-EI mass spectrometry, and gas-phase thermochemical properties from quantum chemical calculations.
Authors: Molano, Miguel Fernando1 (AUTHOR), Gómez Gómez, Alba Marcela1 (AUTHOR), Moncayo-Lasso, Alejandro1 (AUTHOR), Bejarano, Carlos A.1 (AUTHOR), Diaz, John Edward1 (AUTHOR), Buendía-Atencio, Cristian1 (AUTHOR) sol.mejia@javeriana.edu.co, Delgado, Miguel Ángel2 (AUTHOR), Lorett Velásquez, Vaneza Paola3 (AUTHOR), Loaiza, Alix E.4 (AUTHOR), Mejía, Sol M.4 (AUTHOR) c.buendia@uan.edu.co
Source: PLoS ONE. 6/1/2026, Vol. 21 Issue 6, p1-15. 15p.
Database: Academic Search Ultimate
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ISSN:19326203
DOI:10.1371/journal.pone.0349950