Mechanistic Study of the Collision-Induced Dissociation of Sodium-Cationized Polylactide Oligomers: A Joint Experimental and Theoretical Investigation

De Winter, Julien; Lemaur, Vincent; Marsal, Philippe; Coulembier, Olivier; Cornil, Jérôme; Dubois, Philippe; Gerbaux, Pascal

doi:10.1016/j.jasms.2010.03.026

Article (Scientific journals)

Mechanistic Study of the Collision-Induced Dissociation of Sodium-Cationized Polylactide Oligomers: A Joint Experimental and Theoretical Investigation

De Winter, Julien; Lemaur, Vincent; Marsal, Philippe et al.

2010 • In Journal of the American Society for Mass Spectrometry, 21 (7), p. 1159-1168

Peer Reviewed verified by ORBi

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https://hdl.handle.net/20.500.12907/19062

DOI
10.1016/j.jasms.2010.03.026

PubMed
20427201

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Abstract :

[en] The low-kinetic energy collision-induced dissociation (CID) behavior of different sodiumcationized polylactide (PLA) oligomers was thoroughly investigated to shed some light on the analytical potentialities of CID experiments in the context of polymer characterization. Indeed, investigation of several end-groups modified PLA reveal that, in addition to the expected end-group specific dissociations, collisionally-excited PLA.N suffer from a backbone cleavage. The so-obtained sodium-bound dimer cations consecutively undergo the loss of a monomeric residue that corresponds to neutral acrylic acid. The experimental observations, performed on a hybrid Q-ToF instrument, were totally corroborated by a theoretical study involving DFT calculations, molecular mechanics, and molecular dynamics calculations.

Disciplines :

Chemistry
Physics

Author, co-author :

De Winter, Julien ; Université de Mons > Faculté des Sciences > Synthèse et spectrométrie de masse organiques

Lemaur, Vincent ; Université de Mons > Faculté des Sciences > Chimie des matériaux nouveaux

Marsal, Philippe

Coulembier, Olivier ; Université de Mons > Faculté des Sciences > Matériaux Polymères et Composites

Cornil, Jérôme ; Université de Mons > Faculté des Sciences > Chimie des matériaux nouveaux

Dubois, Philippe ; Université de Mons > Faculté des Sciences > Matériaux Polymères et Composites

Gerbaux, Pascal ; Université de Mons > Faculté des Sciences > Synthèse et spectrométrie de masse organiques

Language :

English

Title :

Mechanistic Study of the Collision-Induced Dissociation of Sodium-Cationized Polylactide Oligomers: A Joint Experimental and Theoretical Investigation

Publication date :

01 July 2010

Journal title :

Journal of the American Society for Mass Spectrometry

ISSN :

1044-0305

eISSN :

1879-1123

Publisher :

Springer, New-York, United States - New York

Volume :

Issue :

Pages :

1159-1168

Peer reviewed :

Peer Reviewed verified by ORBi

Research unit :

S816 - Matériaux Polymères et Composites
S817 - Chimie des matériaux nouveaux
S836 - Synthèse et spectrométrie de masse organiques

Research institute :

R400 - Institut de Recherche en Science et Ingénierie des Matériaux

Commentary :

Publié en ligne le 27 mars 2010 Lecture en ligne: http://www.sciencedirect.com/science?_ob=MImg&_imagekey=B6TH2-4YPT1R8-2-17&_cdi=5270&_user=532054&_pii=S1044030510002163&_origin=search&_coverDate=07%2F31%2F2010&_sk=999789992&view=c&wchp=dGLbVlb-zSkzV&md5=51f23475a83cef8d0f82d47fc82088e

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