A series of 4-substituted 3-hydroxyfurazans were subjected to electrospray ionization tandem mass spectrometry. At low collision energy, oxyisocyanate ([O=C=N-O](-) , m/z 58) was formed as the predominant product ion from each deprotonated 3-hydroxyfurazan, indicating cleavage of the heterocyclic ring. The facile energetics of this characteristic fragmentation process was confirmed by density functional computations.

Heterocyclic ring cleavage upon collision-induced dissociation of deprotonated 3-hydroxy-1,2,5-oxadiazoles (3-hydroxyfurazans)

PIPPIONE, Agnese Chiara;BOSCHI, Donatella;LOLLI, Marco Lucio;
2015-01-01

Abstract

A series of 4-substituted 3-hydroxyfurazans were subjected to electrospray ionization tandem mass spectrometry. At low collision energy, oxyisocyanate ([O=C=N-O](-) , m/z 58) was formed as the predominant product ion from each deprotonated 3-hydroxyfurazan, indicating cleavage of the heterocyclic ring. The facile energetics of this characteristic fragmentation process was confirmed by density functional computations.
2015
50
12
1433
1437
http://onlinelibrary.wiley.com/doi/10.1002/jms.3724/abstract
fragmentation mechanisms, heterocycles, 3-hydroxyfurazan, negative ion, computations, tandem mass spectrometry
J. Stuart Grossert; Agnese C. Pippione; Donatella Boschi; Marco L. Lolli; Robert L. White
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/2318/1544252
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