Constraining the sensitivity of iodide adduct chemical ionization mass spectrometry to multifunctional organic molecules using the collision limit and thermodynamic stability of iodide ion adducts

Lopez-Hilfiker, Felipe D.; Iyer, Siddarth; Mohr, Claudia; Lee, Ben H.; D'Ambro, Emma L.; Kurtén, Theo; Thornton, Joel A.

doi:10.5194/amt-9-1505-2016

Title: Constraining the sensitivity of iodide adduct chemical ionization mass spectrometry to multifunctional organic molecules using the collision limit and thermodynamic stability of iodide ion adducts

Journal Article · Wed Apr 06 00:00:00 EDT 2016 · Atmospheric Measurement Techniques (Online)

DOI:https://doi.org/10.5194/amt-9-1505-2016· OSTI ID:1245630

Lopez-Hilfiker, Felipe D.;

;

; Lee, Ben H.;

; Kurtén, Theo; Thornton, Joel A.

The sensitivity of a chemical ionization mass spectrometer (ions formed per number density of analytes) is fundamentally limited by the collision frequency between reagent ions and analytes, known as the collision limit, the ion–molecule reaction time, and the transmission efficiency of product ions to the detector. We use the response of a time-of-flight chemical ionization mass spectrometer (ToF-CIMS) to N₂O₅, known to react with iodide at the collision limit, to constrain the combined effects of ion–molecule reaction time, which is strongly influenced by mixing and ion losses in the ion–molecule reaction drift tube. A mass spectrometric voltage scanning procedure elucidates the relative binding energies of the ion adducts, which influence the transmission efficiency of molecular ions through the electric fields within the vacuum chamber. Together, this information provides a critical constraint on the sensitivity of a ToF-CIMS towards a wide suite of routinely detected multifunctional organic molecules for which no calibration standards exist. We describe the scanning procedure and collision limit determination, and we show results from the application of these constraints to the measurement of organic aerosol composition at two different field locations.

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Research Organization:: Univ. of Washington, Seattle, WA (United States)

Sponsoring Organization:: USDOE Office of Science (SC)

Grant/Contract Number:: SC0006867; SC0011791

OSTI ID:: 1245630

Alternate ID(s):: OSTI ID: 1258742; OSTI ID: 1392631

Journal Information:: Atmospheric Measurement Techniques (Online), Journal Name: Atmospheric Measurement Techniques (Online) Vol. 9 Journal Issue: 4; ISSN 1867-8548

Publisher:: Copernicus Publications, EGUCopyright Statement

Country of Publication:: Germany

Language:: English

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Cited by: 98 works

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References (26)

High-resolution chemical ionization mass spectrometry (ToF-CIMS): application to study SOA composition and processing Aljawhary, D.; Lee, A. K. Y.; Abbatt, J. P. D. Atmospheric Measurement Techniques, Vol. 6, Issue 11 https://doi.org/10.5194/amt-6-3211-2013	journal	January 2013
Development of Ion Drift-Chemical Ionization Mass Spectrometry Fortner, Edward C.; Zhao, Jun; Zhang, Renyi Analytical Chemistry, Vol. 76, Issue 18 https://doi.org/10.1021/ac0493222	journal	September 2004
A high-resolution mass spectrometer to measure atmospheric ion composition Junninen, H.; Ehn, M.; Petäjä, T. Atmospheric Measurement Techniques, Vol. 3, Issue 4 https://doi.org/10.5194/amt-3-1039-2010	journal	January 2010
Chlorine activation by N ₂ O ₅ : simultaneous, in situ detection of ClNO ₂ and N ₂ O ₅ by chemical ionization mass spectrometry Kercher, J. P.; Riedel, T. P.; Thornton, J. A. Atmospheric Measurement Techniques, Vol. 2, Issue 1 https://doi.org/10.5194/amt-2-193-2009	journal	January 2009
Known and Unexplored Organic Constituents in the Earth's Atmosphere Goldstein, Allen H.; Galbally, Ian E. Environmental Science & Technology, Vol. 41, Issue 5 https://doi.org/10.1021/es072476p	journal	March 2007
In-situ measurement of atmospheric NO ₃ and N ₂ O ₅ via cavity ring-down spectroscopy Brown, Steven S.; Stark, Harald; Ciciora, Steven J. Geophysical Research Letters, Vol. 28, Issue 17 https://doi.org/10.1029/2001GL013303	journal	September 2001
Field-Deployable, High-Resolution, Time-of-Flight Aerosol Mass Spectrometer DeCarlo, Peter F.; Kimmel, Joel R.; Trimborn, Achim Analytical Chemistry, Vol. 78, Issue 24 https://doi.org/10.1021/ac061249n	journal	December 2006
A thermal dissociation laser-induced fluorescence instrument for in situ detection of NO ₂ , peroxy nitrates, alkyl nitrates, and HNO ₃ : DETECTION OF NO Day, D. A.; Wooldridge, P. J.; Dillon, M. B. Journal of Geophysical Research: Atmospheres, Vol. 107, Issue D6 https://doi.org/10.1029/2001JD000779	journal	March 2002
Measurements of gas-phase inorganic and organic acids from biomass fires by negative-ion proton-transfer chemical-ionization mass spectrometry Veres, Patrick; Roberts, James M.; Burling, Ian R. Journal of Geophysical Research, Vol. 115, Issue D23 https://doi.org/10.1029/2010JD014033	journal	January 2010
A Chemical Ionization High-Resolution Time-of-Flight Mass Spectrometer Coupled to a Micro Orifice Volatilization Impactor (MOVI-HRToF-CIMS) for Analysis of Gas and Particle-Phase Organic Species Yatavelli, Reddy L. N.; Lopez-Hilfiker, Felipe; Wargo, Julia D. Aerosol Science and Technology, Vol. 46, Issue 12 https://doi.org/10.1080/02786826.2012.712236	journal	December 2012
Modeling the Detection of Organic and Inorganic Compounds Using Iodide-Based Chemical Ionization Iyer, Siddharth; Lopez-Hilfiker, Felipe; Lee, Ben H. The Journal of Physical Chemistry A, Vol. 120, Issue 4 https://doi.org/10.1021/acs.jpca.5b09837	journal	January 2016
Analysis of the chemical composition of organic aerosol at the Mt. Sonnblick observatory using a novel high mass resolution thermal-desorption proton-transfer-reaction mass-spectrometer (hr-TD-PTR-MS) Holzinger, R.; Kasper-Giebl, A.; Staudinger, M. Atmospheric Chemistry and Physics, Vol. 10, Issue 20 https://doi.org/10.5194/acp-10-10111-2010	journal	January 2010
Chemical ionisation mass spectrometry for the measurement of atmospheric amines Yu, Huan; Lee, Shan-Hu Environmental Chemistry, Vol. 9, Issue 3 https://doi.org/10.1071/EN12020	journal	January 2012
Phase partitioning and volatility of secondary organic aerosol components formed from α-pinene ozonolysis and OH oxidation: the importance of accretion products and other low volatility compounds Lopez-Hilfiker, F. D.; Mohr, C.; Ehn, M. Atmospheric Chemistry and Physics, Vol. 15, Issue 14 https://doi.org/10.5194/acp-15-7765-2015	journal	January 2015
A novel method for online analysis of gas and particle composition: description and evaluation of a Filter Inlet for Gases and AEROsols (FIGAERO) Lopez-Hilfiker, F. D.; Mohr, C.; Ehn, M. Atmospheric Measurement Techniques, Vol. 7, Issue 4 https://doi.org/10.5194/amt-7-983-2014	journal	January 2014
Reactions of SF6- and I- with Atmospheric Trace Gases Huey, L. Gregory; Hanson, David R.; Howard, Carleton J. The Journal of Physical Chemistry, Vol. 99, Issue 14 https://doi.org/10.1021/j100014a021	journal	April 1995
A thermal dissociation–chemical ionization mass spectrometry (TD-CIMS) technique for the simultaneous measurement of peroxyacyl nitrates and dinitrogen pentoxide Slusher, Darlene L. Journal of Geophysical Research, Vol. 109, Issue D19 https://doi.org/10.1029/2004JD004670	journal	January 2004
A field-deployable, chemical ionization time-of-flight mass spectrometer Bertram, T. H.; Kimmel, J. R.; Crisp, T. A. Atmospheric Measurement Techniques, Vol. 4, Issue 7 https://doi.org/10.5194/amt-4-1471-2011	journal	January 2011
A Chemical Ionization Mass Spectrometry Method for the Online Analysis of Organic Aerosols Hearn, John D.; Smith, Geoffrey D. Analytical Chemistry, Vol. 76, Issue 10 https://doi.org/10.1021/ac049948s	journal	May 2004
An experimental technique for the direct measurement of N ₂ O ₅ reactivity on ambient particles Bertram, T. H.; Thornton, J. A.; Riedel, T. P. Atmospheric Measurement Techniques, Vol. 2, Issue 1 https://doi.org/10.5194/amt-2-231-2009	journal	January 2009
A switchable reagent ion high resolution time-of-flight chemical ionization mass spectrometer for real-time measurement of gas phase oxidized species: characterization from the 2013 southern oxidant and aerosol study Brophy, P.; Farmer, D. K. Atmospheric Measurement Techniques, Vol. 8, Issue 7 https://doi.org/10.5194/amt-8-2945-2015	journal	January 2015
Development of negative-ion proton-transfer chemical-ionization mass spectrometry (NI-PT-CIMS) for the measurement of gas-phase organic acids in the atmosphere Veres, Patrick; Roberts, James M.; Warneke, Carsten International Journal of Mass Spectrometry, Vol. 274, Issue 1-3 https://doi.org/10.1016/j.ijms.2008.04.032	journal	July 2008
An Iodide-Adduct High-Resolution Time-of-Flight Chemical-Ionization Mass Spectrometer: Application to Atmospheric Inorganic and Organic Compounds Lee, Ben H.; Lopez-Hilfiker, Felipe D.; Mohr, Claudia Environmental Science & Technology, Vol. 48, Issue 11 https://doi.org/10.1021/es500362a	journal	May 2014
Atmospheric sulphuric acid and neutral cluster measurements using CI-APi-TOF Jokinen, T.; Sipilä, M.; Junninen, H. Atmospheric Chemistry and Physics, Vol. 12, Issue 9 https://doi.org/10.5194/acp-12-4117-2012	journal	January 2012
An online ultra-high sensitivity Proton-transfer-reaction mass-spectrometer combined with switchable reagent ion capability (PTR+SRI−MS) Jordan, A.; Haidacher, S.; Hanel, G. International Journal of Mass Spectrometry, Vol. 286, Issue 1 https://doi.org/10.1016/j.ijms.2009.06.006	journal	September 2009
Atmospheric amines and ammonia measured with a chemical ionization mass spectrometer (CIMS) You, Y.; Kanawade, V. P.; de Gouw, J. A. Atmospheric Chemistry and Physics, Vol. 14, Issue 22 https://doi.org/10.5194/acp-14-12181-2014	journal	January 2014

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37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
iodide adduct
chemical ionization
mass spectrometry
organic ion adducts

Title: Constraining the sensitivity of iodide adduct chemical ionization mass spectrometry to multifunctional organic molecules using the collision limit and thermodynamic stability of iodide ion adducts

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