Ion mobility-high resolution mass spectrometry in doping control analysis. Part II: Comparison of acquisition modes with and without ion mobility

نویسندگان

چکیده

In the second part of this study, a systematic comparison was made between two ion fragmentation acquisition modes, namely data-independent (DIA) and DIA with mobility spectrometry (IMS) technology. These approaches were applied to analysis 192 doping agents in urine. Group I included 102 compounds such as stimulants, diuretics, narcotics, β2-agonists, while II contained 90 steroids, glucocorticoids, hormone metabolic modulators. Important method parameters examined compared, including fragmentation, sensitivity, assignment capability minimum occurrence false positive hits. The results differed number detected fragments when exploring MS/MS spectra. only 13%, 64% substances had higher DIA-IMS mode vs. DIA. terms performance modes without activated IMS dimension identical for about 50% agents. sensitivity IMS, i.e. simple mode, 20–40% remaining Despite reduction 82% from both Groups met required level (MRPL) criteria World Anti-Doping Agency (WADA) applied. Automated data processing is important routine analysis. Therefore, methods optimized evaluated prevalence peak assignments by analysing target at different concentrations urine samples. Overall, significantly misidentified observed II, an almost 2-fold misidentifications compared DIA-IMS. This result highlights benefit reduce rate screening UHPLC-IM-HRMS finally samples administration studies nine Groups. However, limit interferences biological matrix, emphasis needed on adequate settings method.

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ژورنال

عنوان ژورنال: Analytica Chimica Acta

سال: 2021

ISSN: ['0003-2670', '1873-4324']

DOI: https://doi.org/10.1016/j.aca.2021.338739