Application of the atoms in molecules theory and computational chemistry in mass spectrometry analysis of 1,4-naphthoquinone derivatives

Journal of Physical Chemistry A

Volumn 115, Issue 45, 2011, Pages 12780-12788

  Vessecchi, Ricardo ^a   Lopes, José N C ^a   Lopes, Norberto P ^a   Galembeck, Sérgio E ^a  

^a UNIVERSITY OF SÃO PAULO   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

1 ,4-NAPHTHOQUINONE; ATOMS IN MOLECULES; ATOMS IN MOLECULES THEORY; COLLISION-INDUCED DISSOCIATION; EQUILIBRIUM GEOMETRIES; FRAGMENTATION MECHANISM; FRAGMENTATION PATHWAYS; FUKUI FUNCTIONS; HYDROGEN ATOMS; ION FORMATION; LATERAL CHAINS; MASS SPECTROMETRY ANALYSIS; MOLECULAR ELECTROSTATIC POTENTIALS; PROTON AFFINITY; PROTONATED; PROTONATED MOLECULES; PROTONATION SITE; TANDEM MASS SPECTROMETRY; TOPOLOGY ANALYSIS;

ATOMS; COMPUTATION THEORY; COMPUTATIONAL CHEMISTRY; ELECTROSPRAY IONIZATION; GEOMETRY; HYDROGEN; HYDROGEN BONDS; ION SOURCES; IONS; KETONES; MASS SPECTROMETRY; MOLECULES; PROTONATION;

CHEMICAL ANALYSIS;

1,4 NAPHTHOQUINONE; 1,4-NAPHTHOQUINONE; NAPHTHOQUINONE;

ARTICLE; CHEMICAL STRUCTURE; MASS SPECTROMETRY; QUANTUM THEORY;

MASS SPECTROMETRY; MOLECULAR STRUCTURE; NAPHTHOQUINONES; QUANTUM THEORY;

EID: 80855164491     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp203912d     Document Type: Article

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