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Updated: Jan 26, 2026

Chromatographic Fingerprinting by Template Matching for Data Collected by Comprehensive Two-Dimensional Gas Chromatography
Published on: September 2, 2020
Differentiation of avocados according to their botanical variety using liquid chromatographic fingerprinting and
Sandra Martín-Torres1, Ana M Jiménez-Carvelo1, Antonio González-Casado1
1Department of Analytical Chemistry, University of Granada, Granada, Spain.
Background:
The oil content, composition and marketing threshold value of an avocado depends on the cultivar hence, identifying the cultivar of the avocado fruit is desirable. However, analytical methods have not been reported with this aim.
Results:
A multivariate classification tree method was proposed to discriminate three commercial botanical varieties of avocado: Hass, Fuerte and Bacon, using high-performance liquid chromatography coupled to a charged aerosol detector (HPLC-CAD). Prior to the chromatographic analysis the avocados were lyophilized and then the oil fraction was extracted using a pressurized liquid extraction system. Normal and reverse phase liquid chromatography were applied in order to obtain the chromatographic fingerprint for each sample. Soft independent modelling of class analogies (SIMCA) and partial least-squares discriminant analysis (PLS-DA) were applied. Classification quality metrics were determined to evaluate the performance of the classification. Several strategies to develop the classification models were employed. Finally, the useful application of 'classification trees' methodology, which has been scarcely applied in the field of analytical food control, was evaluated to perform a multiclass classification.
Conclusion:
Discrimination of the three botanical varieties was achieved. The best classification was obtained when the PLS-DA is applied on the normal-phase chromatographic fingerprints. Classification trees are showed to be useful tools that provide complementary information to single concatenated models showing different results from the same prediction sample set. © 2019 Society of Chemical Industry.
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