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Application of Multivariable Analysis and FTIR-ATR Spectroscopy to the Prediction of Properties in Campeche Honey

Attenuated total reflectance-Fourier transform infrared spectrometry and chemometrics model was used for determination of physicochemical properties (pH, redox potential, free acidity, electrical conductivity, moisture, total soluble solids (TSS), ash, and HMF) in honey samples. The reference values...

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Autores principales: Anguebes, Francisco, Pat, Lucio, Ali, Bassam, Guerrero, Armando, Córdova, Atl V., Abatal, Mohamed, Garduza, José P.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Hindawi Publishing Corporation 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5192472/
https://www.ncbi.nlm.nih.gov/pubmed/28070445
http://dx.doi.org/10.1155/2016/5427526
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author Anguebes, Francisco
Pat, Lucio
Ali, Bassam
Guerrero, Armando
Córdova, Atl V.
Abatal, Mohamed
Garduza, José P.
author_facet Anguebes, Francisco
Pat, Lucio
Ali, Bassam
Guerrero, Armando
Córdova, Atl V.
Abatal, Mohamed
Garduza, José P.
author_sort Anguebes, Francisco
collection PubMed
description Attenuated total reflectance-Fourier transform infrared spectrometry and chemometrics model was used for determination of physicochemical properties (pH, redox potential, free acidity, electrical conductivity, moisture, total soluble solids (TSS), ash, and HMF) in honey samples. The reference values of 189 honey samples of different botanical origin were determined using Association Official Analytical Chemists, (AOAC), 1990; Codex Alimentarius, 2001, International Honey Commission, 2002, methods. Multivariate calibration models were built using partial least squares (PLS) for the measurands studied. The developed models were validated using cross-validation and external validation; several statistical parameters were obtained to determine the robustness of the calibration models: (PCs) optimum number of components principal, (SECV) standard error of cross-validation, (R (2) (cal)) coefficient of determination of cross-validation, (SEP) standard error of validation, and (R (2) (val)) coefficient of determination for external validation and coefficient of variation (CV). The prediction accuracy for pH, redox potential, electrical conductivity, moisture, TSS, and ash was good, while for free acidity and HMF it was poor. The results demonstrate that attenuated total reflectance-Fourier transform infrared spectrometry is a valuable, rapid, and nondestructive tool for the quantification of physicochemical properties of honey.
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spelling pubmed-51924722017-01-09 Application of Multivariable Analysis and FTIR-ATR Spectroscopy to the Prediction of Properties in Campeche Honey Anguebes, Francisco Pat, Lucio Ali, Bassam Guerrero, Armando Córdova, Atl V. Abatal, Mohamed Garduza, José P. J Anal Methods Chem Research Article Attenuated total reflectance-Fourier transform infrared spectrometry and chemometrics model was used for determination of physicochemical properties (pH, redox potential, free acidity, electrical conductivity, moisture, total soluble solids (TSS), ash, and HMF) in honey samples. The reference values of 189 honey samples of different botanical origin were determined using Association Official Analytical Chemists, (AOAC), 1990; Codex Alimentarius, 2001, International Honey Commission, 2002, methods. Multivariate calibration models were built using partial least squares (PLS) for the measurands studied. The developed models were validated using cross-validation and external validation; several statistical parameters were obtained to determine the robustness of the calibration models: (PCs) optimum number of components principal, (SECV) standard error of cross-validation, (R (2) (cal)) coefficient of determination of cross-validation, (SEP) standard error of validation, and (R (2) (val)) coefficient of determination for external validation and coefficient of variation (CV). The prediction accuracy for pH, redox potential, electrical conductivity, moisture, TSS, and ash was good, while for free acidity and HMF it was poor. The results demonstrate that attenuated total reflectance-Fourier transform infrared spectrometry is a valuable, rapid, and nondestructive tool for the quantification of physicochemical properties of honey. Hindawi Publishing Corporation 2016 2016-12-14 /pmc/articles/PMC5192472/ /pubmed/28070445 http://dx.doi.org/10.1155/2016/5427526 Text en Copyright © 2016 Francisco Anguebes et al. https://creativecommons.org/licenses/by/4.0/ This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.
spellingShingle Research Article
Anguebes, Francisco
Pat, Lucio
Ali, Bassam
Guerrero, Armando
Córdova, Atl V.
Abatal, Mohamed
Garduza, José P.
Application of Multivariable Analysis and FTIR-ATR Spectroscopy to the Prediction of Properties in Campeche Honey
title Application of Multivariable Analysis and FTIR-ATR Spectroscopy to the Prediction of Properties in Campeche Honey
title_full Application of Multivariable Analysis and FTIR-ATR Spectroscopy to the Prediction of Properties in Campeche Honey
title_fullStr Application of Multivariable Analysis and FTIR-ATR Spectroscopy to the Prediction of Properties in Campeche Honey
title_full_unstemmed Application of Multivariable Analysis and FTIR-ATR Spectroscopy to the Prediction of Properties in Campeche Honey
title_short Application of Multivariable Analysis and FTIR-ATR Spectroscopy to the Prediction of Properties in Campeche Honey
title_sort application of multivariable analysis and ftir-atr spectroscopy to the prediction of properties in campeche honey
topic Research Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5192472/
https://www.ncbi.nlm.nih.gov/pubmed/28070445
http://dx.doi.org/10.1155/2016/5427526
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