Formation of positive product ions from substances with low proton affinity in high kinetic energy ion mobility spectrometry

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OriginalspracheEnglisch
Aufsatznummere8998
FachzeitschriftRapid Communications in Mass Spectrometry
Jahrgang35
Ausgabenummer4
Frühes Online-Datum3 Nov. 2020
PublikationsstatusVeröffentlicht - 7 Jan. 2021

Abstract

Rationale: Ion mobility spectrometry (IMS) instruments are typically equipped with atmospheric pressure chemical ionization (APCI) sources operated at ambient pressure. However, classical APCI-IMS suffers from a limited ionization yield for nonpolar substances with low proton affinity (PA). This is mainly due to ion clustering processes, especially those that involve water molecules, inhibiting the ionization of these substances. Methods: High Kinetic Energy (HiKE)-IMS instruments are operated at decreased pressures and high reduced electric field strengths. As most clustering reactions are inhibited under these conditions, the ionization yield for nonpolar substances with low PA in HiKE-IMS should differ from that in classical APCI-IMS. To gain first insights into the ionization capabilities and limitations of HiKE-IMS, we investigated the ionization of four model substances with low PA in HiKE-IMS using HiKE-IMSMS as a function of the reduced electric field strength. Results: The four model substances all have proton affinities between those of H2O and (H2O)2 but exhibit different ionization energies, dipole moments, and polarizabilities. As expected, the results show that the ionization yield for these substances differs considerably at low reduced electric field strengths due to ion cluster formation. In contrast, at high reduced electric field strengths, all substances can be ionized via charge and/or proton transfer in HiKE-IMS. Conclusions: Considering the detection of polar substances with high PAs, classical ambient pressure IMS should reach better detection limits than HiKE-IMS. However, considering the detection of nonpolar substances with low PA that are not detected, or only difficult to detect, at ambient pressure, HiKE-IMS would be beneficial.

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Formation of positive product ions from substances with low proton affinity in high kinetic energy ion mobility spectrometry. / Allers, Maria; Kirk, Ansgar T.; Schaefer, Christoph et al.
in: Rapid Communications in Mass Spectrometry, Jahrgang 35, Nr. 4, e8998, 07.01.2021.

Publikation: Beitrag in FachzeitschriftArtikelForschungPeer-Review

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title = "Formation of positive product ions from substances with low proton affinity in high kinetic energy ion mobility spectrometry",
abstract = "Rationale: Ion mobility spectrometry (IMS) instruments are typically equipped with atmospheric pressure chemical ionization (APCI) sources operated at ambient pressure. However, classical APCI-IMS suffers from a limited ionization yield for nonpolar substances with low proton affinity (PA). This is mainly due to ion clustering processes, especially those that involve water molecules, inhibiting the ionization of these substances. Methods: High Kinetic Energy (HiKE)-IMS instruments are operated at decreased pressures and high reduced electric field strengths. As most clustering reactions are inhibited under these conditions, the ionization yield for nonpolar substances with low PA in HiKE-IMS should differ from that in classical APCI-IMS. To gain first insights into the ionization capabilities and limitations of HiKE-IMS, we investigated the ionization of four model substances with low PA in HiKE-IMS using HiKE-IMSMS as a function of the reduced electric field strength. Results: The four model substances all have proton affinities between those of H2O and (H2O)2 but exhibit different ionization energies, dipole moments, and polarizabilities. As expected, the results show that the ionization yield for these substances differs considerably at low reduced electric field strengths due to ion cluster formation. In contrast, at high reduced electric field strengths, all substances can be ionized via charge and/or proton transfer in HiKE-IMS. Conclusions: Considering the detection of polar substances with high PAs, classical ambient pressure IMS should reach better detection limits than HiKE-IMS. However, considering the detection of nonpolar substances with low PA that are not detected, or only difficult to detect, at ambient pressure, HiKE-IMS would be beneficial.",
author = "Maria Allers and Kirk, {Ansgar T.} and Christoph Schaefer and Florian Schlottmann and Stefan Zimmermann",
note = "Funding Information: The authors thank Airsense Analytics for providing the chemicals used in this work. This work was funded by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation), joint project BE 2124/8-1?ZI 1288/8-1. Open access funding enabled and organized by Projekt DEAL.",
year = "2021",
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doi = "10.1002/rcm.8998",
language = "English",
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TY - JOUR

T1 - Formation of positive product ions from substances with low proton affinity in high kinetic energy ion mobility spectrometry

AU - Allers, Maria

AU - Kirk, Ansgar T.

AU - Schaefer, Christoph

AU - Schlottmann, Florian

AU - Zimmermann, Stefan

N1 - Funding Information: The authors thank Airsense Analytics for providing the chemicals used in this work. This work was funded by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation), joint project BE 2124/8-1?ZI 1288/8-1. Open access funding enabled and organized by Projekt DEAL.

PY - 2021/1/7

Y1 - 2021/1/7

N2 - Rationale: Ion mobility spectrometry (IMS) instruments are typically equipped with atmospheric pressure chemical ionization (APCI) sources operated at ambient pressure. However, classical APCI-IMS suffers from a limited ionization yield for nonpolar substances with low proton affinity (PA). This is mainly due to ion clustering processes, especially those that involve water molecules, inhibiting the ionization of these substances. Methods: High Kinetic Energy (HiKE)-IMS instruments are operated at decreased pressures and high reduced electric field strengths. As most clustering reactions are inhibited under these conditions, the ionization yield for nonpolar substances with low PA in HiKE-IMS should differ from that in classical APCI-IMS. To gain first insights into the ionization capabilities and limitations of HiKE-IMS, we investigated the ionization of four model substances with low PA in HiKE-IMS using HiKE-IMSMS as a function of the reduced electric field strength. Results: The four model substances all have proton affinities between those of H2O and (H2O)2 but exhibit different ionization energies, dipole moments, and polarizabilities. As expected, the results show that the ionization yield for these substances differs considerably at low reduced electric field strengths due to ion cluster formation. In contrast, at high reduced electric field strengths, all substances can be ionized via charge and/or proton transfer in HiKE-IMS. Conclusions: Considering the detection of polar substances with high PAs, classical ambient pressure IMS should reach better detection limits than HiKE-IMS. However, considering the detection of nonpolar substances with low PA that are not detected, or only difficult to detect, at ambient pressure, HiKE-IMS would be beneficial.

AB - Rationale: Ion mobility spectrometry (IMS) instruments are typically equipped with atmospheric pressure chemical ionization (APCI) sources operated at ambient pressure. However, classical APCI-IMS suffers from a limited ionization yield for nonpolar substances with low proton affinity (PA). This is mainly due to ion clustering processes, especially those that involve water molecules, inhibiting the ionization of these substances. Methods: High Kinetic Energy (HiKE)-IMS instruments are operated at decreased pressures and high reduced electric field strengths. As most clustering reactions are inhibited under these conditions, the ionization yield for nonpolar substances with low PA in HiKE-IMS should differ from that in classical APCI-IMS. To gain first insights into the ionization capabilities and limitations of HiKE-IMS, we investigated the ionization of four model substances with low PA in HiKE-IMS using HiKE-IMSMS as a function of the reduced electric field strength. Results: The four model substances all have proton affinities between those of H2O and (H2O)2 but exhibit different ionization energies, dipole moments, and polarizabilities. As expected, the results show that the ionization yield for these substances differs considerably at low reduced electric field strengths due to ion cluster formation. In contrast, at high reduced electric field strengths, all substances can be ionized via charge and/or proton transfer in HiKE-IMS. Conclusions: Considering the detection of polar substances with high PAs, classical ambient pressure IMS should reach better detection limits than HiKE-IMS. However, considering the detection of nonpolar substances with low PA that are not detected, or only difficult to detect, at ambient pressure, HiKE-IMS would be beneficial.

UR - http://www.scopus.com/inward/record.url?scp=85100125753&partnerID=8YFLogxK

U2 - 10.1002/rcm.8998

DO - 10.1002/rcm.8998

M3 - Article

C2 - 33140479

AN - SCOPUS:85100125753

VL - 35

JO - Rapid Communications in Mass Spectrometry

JF - Rapid Communications in Mass Spectrometry

SN - 0951-4198

IS - 4

M1 - e8998

ER -

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