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Applications of Quadrupole Ion Traps

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2010, Doctor of Philosophy (PhD), Ohio University, Chemistry and Biochemistry (Arts and Sciences).

Quadrupole ion trap mass spectrometry (QIT-MS) is used for the scientific analysis of a variety of different areas due to the relatively low cost and versatility. This research explores the use of quadrupole ions traps (QITs) for the analysis of clinical, environmental, physical chemical, biochemical, and forensic applications.

Solid phase microextraction (SPME) conventional gas chromatography tandem mass spectrometry (GC tandem MS) procedures were used to successfully identify biomarkers of alcohol abuse in human hair. Software modifications to perform fast mass scanning with dynamic collision induced dissociation (DCID) has allowed for increased selectivity and sensitivity for these biomarkers. The detection of pollutant concentrations of water treated by a vegetated biofilter was achieved by using solid phase microextraction (SPME) gas chromatography mass spectrometry (SPME GC/MS). These analyses offer an alternative analysis for organic compounds from stormwater run-off.

With the use of quadrupole ions traps (QITs), we were able to provide the first conclusive evidence that ionic liquids (ILs) can evaporate as free ions or cluster ions under reduced pressure. Enthalpies of vaporization for each ionic liquid (IL) studied could also be calculated through Classeus-Clapeyron-like plots of the mass spectra intensities at different evaporation temperatures. Work described here also compares a fragmentation process called metastable atom-activated dissociation (MAD) in the quadrupole ion trap mass spectrometer (QIT-MS) to electron transfer dissociation (ETD) and collision-activated dissociation (CAD) on a linear ion trap. This work demonstrates that MAD-MS can result in unique and complementary sequence coverage and in comparison to the other dissociation methods. Lastly, a forensic case study describes the use of many analytical techniques, including the use of a QITs with pyrolysis direct insertion probe and in a conventional GC/MS arrangement to determine that a stain on a concrete surface was composed of mainly calcium and sodium salts of free fatty acids that are consistent with adipocere formation.

As we show, quadrupole ion traps (QITs) have the ability to operate in different modes by conventional usage or by hardware or software modifications. The different applications described here demonstrates the adaptability and versatility of QITs to a multitude of areas.

Glen Jackson, PhD (Advisor)
Gayle Mitchell, PhD (Committee Chair)
Peter Harrington, PhD (Committee Member)
Kenneth Brown, PhD (Committee Member)
251 p.

Recommended Citations

Citations

  • Zimmermann, C. M. (2010). Applications of Quadrupole Ion Traps [Doctoral dissertation, Ohio University]. OhioLINK Electronic Theses and Dissertations Center. http://rave.ohiolink.edu/etdc/view?acc_num=ohiou1273176681

    APA Style (7th edition)

  • Zimmermann, Carolyn. Applications of Quadrupole Ion Traps. 2010. Ohio University, Doctoral dissertation. OhioLINK Electronic Theses and Dissertations Center, http://rave.ohiolink.edu/etdc/view?acc_num=ohiou1273176681.

    MLA Style (8th edition)

  • Zimmermann, Carolyn. "Applications of Quadrupole Ion Traps." Doctoral dissertation, Ohio University, 2010. http://rave.ohiolink.edu/etdc/view?acc_num=ohiou1273176681

    Chicago Manual of Style (17th edition)