Recent advances in mass spectrometry-based structural elucidation techniques

X Ma - Molecules, 2022 - mdpi.com
Mass spectrometry (MS) has become the central technique that is extensively used for the
analysis of molecular structures of unknown compounds in the gas phase. It manipulates the …

Chemical Synthesis with Gaseous Molecular Ions: Harvesting [B12Br11N2] from a Mass Spectrometer

M Rohdenburg, Z Warneke, H Knorke… - Angewandte Chemie …, 2023 - Wiley Online Library
Mass spectrometry frequently reveals the existence of transient gas phase ions that have not
been synthesized in solution or in bulk. These elusive ions are, therefore, often considered …

Generation and reactivity of the fragment ion [B 12 I 8 S (CN)]− in the gas phase and on surfaces

S Kawa, J Kaur, H Knorke, Z Warneke, M Wadsack… - Analyst, 2024 - pubs.rsc.org
Gaseous fragment ions generated in mass spectrometers may be employed as “building
blocks” for the synthesis of novel molecules on surfaces using ion soft-landing. A …

Gas-Phase Reactivity of Quinoline-Based Singlet Oxenium Cations

X Ma, RO Anyaeche, E Feng, E Johnson… - The Journal of …, 2024 - ACS Publications
Isomeric quinolyloxenium cations were generated in the gas phase in an ion trap mass
spectrometer to explore their reactions. The structures of some products were identified via …

Effects of the Distance between Radical Sites on the Reactivities of Aromatic Biradicals

D Ding, H Jiang, X Ma, JJ Nash… - The Journal of Organic …, 2020 - ACS Publications
Coupling of the radical sites in isomeric benzynes is known to hinder their radical reactivity.
In order to determine how far apart the radical sites must be for them not to interact, the gas …

Protonated Ground-State Singlet meta-Pyridynes React from an Excited Triplet State

X Ma, E Feng, H Jiang, VM Boulos, J Gao… - The Journal of …, 2021 - ACS Publications
The gaseous 2, 6-didehydropyridinium cation and its derivatives transfer a proton to
reagents for which the reaction for their singlet ground states is too endothermic to be …

Chemische Synthese mit Gasförmigen Molekularen Ionen: Gewinnung von [B12Br11N2]− aus einem Massenspektrometer

M Rohdenburg, Z Warneke, H Knorke… - Angewandte …, 2023 - Wiley Online Library
In der Massenspektrometrie werden häufig kurzlebige Ionen in der Gasphase beobachtet,
die zuvor nicht in Lösung oder in der Bulkphase synthetisiert worden sind. Diese schwer …

Quinoline triradicals: a reactivity study

RR Kotha, R Yerabolu, MS Aqueel… - Journal of the …, 2019 - ACS Publications
The gas-phase reactivities of several protonated quinoline-based σ-type (carbon-centered)
mono-, bi-, and triradicals toward dimethyl disulfide (DMDS) were studied by using a linear …

Spin‐Spin Coupling Controls the Gas‐Phase Reactivity of Aromatic σ‐Type Triradicals

D Ding, E Feng, RR Kotha… - … A European Journal, 2022 - Wiley Online Library
Examination of the reactions of σ‐type quinolinium‐based triradicals with cyclohexane in the
gas phase demonstrated that the radical site that is the least strongly coupled to the other …

ION-MOLECULE REACTIONS STUDIED BY USING DENSITY FUNCTIONAL THEORY CALCULATIONS AND MASS SPECTROMETRY FOR SATURATED …

JR Milton - 2021 - hammer.purdue.edu
The work described herein is related to gas-phase ion-molecule reactions studied by using
mass spectrometry. Chapter 2 describes density functional theory, a method used in …