Dissertation data Archives

The Mass table results corresponding to Figures found within student dissertations are reported below.

Figueroa, A. Dissertation: Novel Mass Spectrometric Approaches For Applications In Forensic Entomology And Chemical Ecology: Insect Species Determination And Discovery Of Semiochemicals

• Chapter 3: Untargeted Metabolomics for Chemotaxonomy of Blow Fly Pupae (Diptera: Calliphoridae) Supported by DNA Barcoding (2026).

  • Appendix C: Alignment Distance Tables

• Chapter 4: Interpretation of DART – High-Resolution Mass Spectra of Organic Sulfides Through High-Level Ab initio/Density Functional Theory Calculations and Tracer Studies (2026).

  • Appendix D: Alignment Distance Tables — Submitted for publication and will be available soon.

Garosi, B. Dissertation: CHEMICAL INTERROGATION OF COMPLEX MATRICES USING AMBIENT IONIZATION MASS SPECTROMETRY: PRACTICAL APPROACHES FOR THE IDENTIFICATION OF SMALL MOLECULES AND MECHANISTIC INTERPRETATION OF METASTABLE HELIUM-PROMOTED GAS PHASE IONS

• Chapter 2: Utilizing Derivatizing Agents for the Differentiation of Cannabinoid Isomers in Complex Matrices by Ambient Ionization Mass Spectrometry (2026).

  • Mass Data Tables Corresponding to Figure 2.4 - 2.8 and Supplemental Figures B.1-B.30.

• Chapter 3: Investigating the Protonated Cannabinoid Dimer Detected in the Forensic Analysis of Cannabis by DART-MS: A Combined Mass Spectrometry and Computational Study (2026).

  • Online Data Repository for Cannabinoid Dimer Gaussian Structure Computations.

• Chapter 4: Experimental and Computational Investigation of Sulfur Chemistry in the DART-MS Gas Stream: Implications for the Interpretation of the Mass Spectra of Organic Disulfides (2026).

  • Mass Data Tables Corresponding to Organic Disulfide Temperature Studies.

  • Mass Data Tables Corresponding to Organic Disulfide Solvent Studies.

• Chapter 5: Interpretation of DART – High-Resolution Mass Spectra of Organic Sulfides Through High-Level Ab initio/Density Functional Theory Calculations and Tracer Studies (2026).

  • Mass Data Tables have been submitted for publication and will be available soon.

Ventura, M.I. Dissertation: Advancement in Forensic Analysis: Development of Mass Spectrometric and Chemometric Approaches for the Identification of Synthetic New Psychoactive Substances and Plant Materials

• Chapter 3: (2024).

  • Mass Data Tables Corresponding to Psychoactive Plants (Figures 3.5 and A4)

• Chapter 4: (2024).

  • Mass Data Tables Corresponding to Dalbergia Species (Figure 4.2)

• Chapter 5: (2024).

  • Mass Data Tables Corresponding to Swietenia Species (Figure 5.3)

• Appendix A: (2024).

  • Mass Data Tables for Tryptamine Project (Figure A1)

  • Mass Data Tables for Tryptamine Project (Figure A2)

  • Mass Data Tables for Tryptamine Project (Figure A2)

  • Mass Data Tables for Tryptamine Project — Original 90V Data for Neutral Loss Spectra (Figure A3)

  • Mass Data Tables for Tryptamine Project — 90V Neutral Loss Spectra (Figure A3)