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Updated: Nov 16, 2025

Chromatographic Fingerprinting by Template Matching for Data Collected by Comprehensive Two-Dimensional Gas Chromatography
Published on: September 2, 2020
Standardization of chromatographic signals - Part II: Expanding instrument-agnostic fingerprints to reverse phase
Luis Cuadros-Rodríguez1, Sandra Martín-Torres1, Fidel Ortega-Gavilán1
1Department of Analytical Chemistry, Faculty of Science, University of Granada, C/ Fuentenueva s/n, E-18071, Granada, Spain.
Abstract:
There is a large amount of literature relating to multivariate analytical methods using liquid chromatography together with multivariate chemometric/data mining methods in the food science field. Nevertheless, dating the obtained results cannot be compared as they are based on data acquired by a particular analytical instrument, thus they are instrument-dependant. Therefore, this creates difficulties in generating a database large enough to gather together all the variability of the samples. The solution to this problem is to obtain an instrument-agnostic chromatographic signal that is independent of the chromatographic state, i.e., measuring instrument or particular condition of the same instrument from which it was acquired. This paper describes the methodology to be followed to obtain standardized instrumental fingerprints when liquid chromatography is used for prior separation. For this purpose both internal and external chemical standards series are used as references. As an application example, we have applied this methodology for the determination of biophenols in olive oil by liquid chromatography coupled to ultraviolet-visible detector (LC-UV), using three different LC-UV instruments. The instrument-agnostic fingerprints obtained show a high grade of similarity, regardless of the state of the chromatographic system or the time of acquisition.
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