Quantitative Profiling

In this thesis the power of electrophoretic on-line concentration procedures for peptidomics and metabolomics is demonstrated. Tow examples are given: isotachophoresis with spacer molecules and electroextraction. Electromigration is capable of enhancing selective analyte migration. Selective analyte migration can be used to increase the amount of analyte that is injected into an analytical system, while it leaves the sample volume with the contaminants behind.

Due to the complexity of typical metabolomics samples and the many steps required to obtain quantitative data in GC × GC-MS consisting of deconvolution, peak picking, peak merging, and integration, the unbiased non-target quantification of GC × GC-MS data still poses a major challenge in metabolomics analysis. The feasibility of using commercially available software for non-target processing of GC × GC-MS data was assessed.

  A high content molecular fragmentation for the analysis of phosphatidylcholines (PC) was achieved utilizing a two-stage [trap (first generation fragmentation) and transfer (second generation fragmentation)] collision-induced dissociation (CID) in combination with travellingwave ion mobility spectrometry (TWIMS).