The Mass Spectrometry society of Japan - The 68th Annual Conference on Mass Spectrometry, Japan

Abstract

Oral Sessions

Day 2, May 20(Thu.) 11:20-11:40 Room F (Zoom)

Structure estimations of positional isomers using energy-resolved MSn

(1OIST, 2Unv. Toyama, 3Kumamoto Univ.)
oYayoi Hongo1, Hiroshi Watanabe1, Katsuhiro Konno2, Kohei Kazuma3

Energy-resolved MSnassisted identification of positional isomers of serotonin detected from a cnidarian extract. Single shot MS2 spectra are often identical among structural analogues, however break-down curves describing dissociation characters distinguish possible -OH positions on an indole ring. Once relationships between structural details and possible reactions were elucidated, they would be worth to be subjected to data mining.