Articles producció científicaQuímica Analítica i Química Orgànica

In-depth chemometric strategy to detect up to four adulterants in cashew nuts by IR spectroscopic techniques

  • Identification data

    Identifier:  imarina:9280616
    Authors:  Rovira, G; Miaw, CSW; Martins, MLC; Sena, MM; de Souza, SVC; Ruisánchez, I; Callao, MP
    Abstract:
    An untargeted strategy was developed to determine cashew nuts adulteration with Brazilian nuts, pecan nuts, macadamia nuts and peanuts. A one-class SIMCA model was developed for the cashew non-adulterated samples by means of two spectroscopic techniques: Near-Infrared (NIR) and Attenuated Total Reflection-Fourier Transform Infrared (ATR-FTIR). Receiver operating characteristic (ROC) curves have been proved to be useful to optimize class limits, both for the NIR and ATR-FTIR models, allowing to balance the values of the performance parameters. An increase in the sensitivity of the training and test set has been obtained from 79% with NIR and 85% with ATR-FTIR to 93% in both cases. As a result, the specificity has slightly decreased from 100% with NIR and a range of 90–98% with ATR-FTIR to a range of 82–98% and 84–96%, respectively. The implementation of high-level data fusion to the classification results obtained from NIR and ATR-FTIR, considering the limit value optimized by ROC curves, allowed the improvement of the performance parameters of the untargeted strategy. Obtaining sensitivity values for the training and test set of 100% and 93%, respectively. Specificity values of 100% were obtained for the detection of Brazilian nuts, macadamia nuts and peanuts, while for pecans it was 98%.
  • Others:

    Link to the original source: https://www.sciencedirect.com/science/article/abs/pii/S0026265X22006440
    APA: Rovira, G; Miaw, CSW; Martins, MLC; Sena, MM; de Souza, SVC; Ruisánchez, I; Callao, MP (2022). In-depth chemometric strategy to detect up to four adulterants in cashew nuts by IR spectroscopic techniques. Microchemical Journal, 181(), 107816-. DOI: 10.1016/j.microc.2022.107816
    Paper original source: Microchemical Journal. 181 107816-
    Article's DOI: 10.1016/j.microc.2022.107816
    Journal publication year: 2022-10-01
    Entity: Universitat Rovira i Virgili
    Paper version: info:eu-repo/semantics/publishedVersion
    Record's date: 2026-05-09
    URV's Author/s: Callao Lasmarias, María Pilar / Rovira Garrido, Glòria / Ruisánchez Capelastegui, María Iciar
    Department: Química Analítica i Química Orgànica
    Licence document URL: https://repositori.urv.cat/ca/proteccio-de-dades/
    Publication Type: Journal Publications
    Author, as appears in the article.: Rovira, G; Miaw, CSW; Martins, MLC; Sena, MM; de Souza, SVC; Ruisánchez, I; Callao, MP
    licence for use: https://creativecommons.org/licenses/by/3.0/es/
    Thematic Areas: Spectroscopy, Ciências ambientais, Ciências agrárias i, Chemistry, analytical, Analytical chemistry, Administração pública e de empresas, ciências contábeis e turismo
    Author's mail: gloria.rovira@alumni.urv.cat, itziar.ruisanchez@urv.cat, itziar.ruisanchez@urv.cat
  • Keywords:

    Untargeted chemometrics
    Roc curve
    One-class simca
    Nir
    Multivariate data-analysis
    High-level data fusion
    Atr-ftir
    validation
    raman
    one -class simca
    midinfrared spectroscopy
    food
    classification
    authentication
    Analytical Chemistry
    Chemistry
    Analytical
    Spectroscopy
    Ciências ambientais
    Ciências agrárias i
    Administração pública e de empresas
    ciências contábeis e turismo
  • Documents:

  • Cerca a google

    Search to google scholar