Elucidating collision induced dissociation products and reaction mechanisms of protonated uracil by coupling chemical dynamics simulations with tandem mass spectrometry experiments

Journal of Mass Spectrometry

Volumn 50, Issue 12, 2015, Pages 1340-1351

  Molina, Estefanía Rossich ^a,b   Ortiz, Daniel ^c,d   Salpin, Jean Yves ^a,b   Spezia, Riccardo ^a,b  

^a UNIVERSITÉ D EVRY VAL D ESSONNE   (France)

^b CNRS   (France)

^c DIF   (France)

^d CNRS   (France)

Author keywords

chemical dynamics simulations; collision induced dissociation; gas phase reaction mechanisms; nucleobase fragmentation; retro Diels Alder

Indexed keywords

AROMATIC COMPOUNDS; CHEMICAL REACTIONS; DISSOCIATION; ELECTROSPRAY IONIZATION; IONIZATION OF GASES; ISOTOPES; MASS SPECTROMETRY; MOLECULAR MODELING; PHASE INTERFACES; PROTONATION; QUANTUM THEORY; SPECTROMETRY;

CHEMICAL DYNAMICS; COLLISION INDUCED DISSOCIATION; DIELS-ALDER; GAS-PHASE REACTIONS; NUCLEOBASES;

DYNAMICS;

AMMONIA; ISOCYANATE; URACIL; PROTON;

ARTICLE; COLLISIONALLY ACTIVATED DISSOCIATION; FRAGMENTATION REACTION; ISOMER; ISOTOPE LABELING; MOLECULAR DYNAMICS; PRIORITY JOURNAL; PROTON TRANSPORT; QUANTUM MECHANICS; REACTION ANALYSIS; TANDEM MASS SPECTROMETRY; WATER LOSS; CHEMISTRY; ELECTROSPRAY MASS SPECTROMETRY; PROCEDURES;

MOLECULAR DYNAMICS SIMULATION; PROTONS; SPECTROMETRY, MASS, ELECTROSPRAY IONIZATION; TANDEM MASS SPECTROMETRY; URACIL;

EID: 84949292895     PISSN: 10765174     EISSN: 10969888     Source Type: Journal    
DOI: 10.1002/jms.3704     Document Type: Article

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