Discrimination of pressed sesame oil: A comparison study of non-targeted UV spectral fingerprints combined with different chemometric methods

Abstract

This study explores the utilization of various chemometric analytical methods for determining the quality of pressed sesame oil with different adulteration levels of refined sesame oil using UV spectral fingerprints. The goal of this study was to provide a reliable tool for assessing the quality of sesame oil. The UV spectra of 51 samples of pressed sesame oil and 420 adulterated samples with refined sesame oil were measured in the range of 200–330 nm. Various classification and prediction methods, including linear discrimination analysis (LDA), support vector machines (SVM), soft independent modeling of class analogy (SIMCA), partial least squares regression (PLSR), support vector machine regression (SVR), and back-propagation neural network (BPNN), were employed to analyze the UV spectral data of pressed sesame oil and adulterated sesame oil. The results indicated that SVM outperformed the other classification methods in qualitatively identifying adulterated sesame oil, achieving an accuracy of 96.15%, a sensitivity of 97.87%, and a specificity of 80%. For quantitative analysis, BPNN yielded the best prediction results, with an R2 value of 0.99, RMSEP of 2.34%, and RPD value of 10.60 (LOD of 8.60% and LOQ of 28.67%). Overall, the developed models exhibited significant potential for rapidly identifying and predicting the quality of sesame oil.