Mass spectrometry distinguishing C=C location and cis/trans isomers: A strategy initiated by water radical cations

We present an approach for the elucidation of C=C bond position and cis/trans isomers, which is achieved by the reaction of ambient water radical cations and double bonds, followed by the fragmentation of epoxide radical cations to generate diagnostic ions in tandem mass spectrometry. Hexenol double...

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Veröffentlicht in:Analytica chimica acta 2020-12, Vol.1139, p.146-154
Hauptverfasser: Zhang, Xiaoping, Ren, Xiang, Chingin, Konstantin, Xu, Jiaquan, Yan, Xin, Chen, Huanwen
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container_title Analytica chimica acta
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creator Zhang, Xiaoping
Ren, Xiang
Chingin, Konstantin
Xu, Jiaquan
Yan, Xin
Chen, Huanwen
description We present an approach for the elucidation of C=C bond position and cis/trans isomers, which is achieved by the reaction of ambient water radical cations and double bonds, followed by the fragmentation of epoxide radical cations to generate diagnostic ions in tandem mass spectrometry. Hexenol double bond positional isomers and cis/trans isomers which exhibit different properties and biological functions are characterized as a proof of concept. The merits of the approach include the simplicity of experimental setup, rapid derivatization (within seconds), the obviation of organic solvents, as well as easy spectral interpretation. [Display omitted] •A novel approach for the elucidation of C=C bond position and cis/trans isomers.•In situ epoxidation reaction of ambient water radical cations and C=C bonds.•No need of special instrumentation and organic solvents.
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subjects Ambient corona discharge ionization mass spectrometry
Carbon-carbon double bond
Cis/trans isomers
Positional isomers
Water radical cations
title Mass spectrometry distinguishing C=C location and cis/trans isomers: A strategy initiated by water radical cations
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