Analytical chemistry council

METHODS AND OBJECTS OF CHEMICAL ANALYSIS

 

An international journal devoted to all aspects of analytical chemistry

ISSN 2413-6166 (Online), ISSN 1991-0290 (Print)

Kiev University
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Determination of LC-PUFAs and Protein Content in Premature infant formula powders by ATR-FTIR Spectroscopy and Chemometrics

Mahyar Sanadgol Nezami†, Alireza Feizbakhsh*†, Amir Bagheri Garmarudi‡

* Corresponding authors

† Department of Chemistry, Faculty of Science, Central Tehran Branch, Islamic Azad University, Tehran, Iran;
‡ Department of Chemistry, Faculty of Science, Imam Khomeini International University, Qazvin, Iran;
*e-mail: ali.fb1970@yahoo.com

Methods Objects Chem. Anal., 2022, 17(1), p. 17-27

https://doi.org/10.17721/moca.2022.17-27

The article is distributed under open access Creative Commons Attribution License CC BY 4.0.

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Supplemental Information

Abstract

Premature infant formula powder (PIFP) contains essential nutrients, such as protein and LC-PUFAs in which inadequate quantities of them may restrict the development of premature infants. The aim of this study was to propose a quantitative analysis for evaluating these nutrients in PIFP. To achieve this purpose, an integrated methodology was developed by combining attenuated total reflectance Fourier-transform infrared spectroscopy (ATR-FTIR) with the chemometrics. ATR-FTIR was utilized to obtain the PIFP spectra in the wavenumber range of 4000-400 cm-1. Principal component analysis (PCA) was employed to perform exploratory analysis of the spectra. Partial least square regression (PLSR) and principal component regression (PCR) models were established for normal spectra, first, and second derivatives to quantitatively determine the protein and LC-PUFAs. The results showed that the PLSR model provided a better prediction than the PCR model with the coefficient of determinations (R2) of 0.992 and 0.983 for training and validation, respectively. It also offers the best prediction for the PLSR model of protein considering the parameters such as R2 (normal spectra) (Cal: 0.995, Val: 0.981). The results revealed that a combination of the ATR-FTIR spectroscopy and the chemometrics models creates a rapid, inexpensive, and non-destructive method for the quantitative analysis of PIFP.

Keywords: ATR-FTIR spectroscopy, chemometrics, LC-PUFAs, premature infant formula powder, protein

Article language: En


Publisher: Taras Shevchenko National University, Kiev Ukraine

(Analytical chemistry department at Taras Shevchenko National University, 64 Vladimirskaya STR., Kiev, 01601 UKRAINE)
analysis@univ.kiev.ua, www.univ.kiev.ua, +380 (44) 2393444

The journal is indexed in SCOPUS and Web of Science

The journal website: www.moca.net.ua

The articles in this journal are licensed under CC BY 4.0