Consecutive Fragmentation Mechanisms of Protonated Ferulic Acid Probed by Infrared Multiple Photon Dissociation Spectroscopy and Electronic Structure Calculations

Protonated ferulic acid and its principle fragment ion have been characterized using infrared multiple photon dissociation spectroscopy and electronic structure calculations at the B3LYP/6-311 + G(d,p) level of theory. Due to its extensively conjugated structure, protonated ferulic acid is observed...

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Veröffentlicht in:	Journal of the American Society for Mass Spectrometry 2012-10, Vol.23 (10), p.1697-1706
Hauptverfasser:	Martens, Sabrina M., Marta, Rick A., Martens, Jonathan K., McMahon, Terry B.
Format:	Artikel
Sprache:	eng
Schlagworte:	Acids Analytical Chemistry Bioinformatics Biotechnology Carbon monoxide Carbon Monoxide - chemistry Chemistry Chemistry and Materials Science Coumaric Acids - chemistry Diagnostic systems Electronic structure Exact sciences and technology Ferulic acid Fragmentation Gases - chemistry Infrared spectroscopy Ions - chemistry Isomerism Mass spectrometry Mass Spectrometry - methods Mathematical analysis Methanol - chemistry Organic Chemistry Proteomics Reactivity and mechanisms Research Article Spectrum analysis Thermodynamics
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