Rapid Determination of Benzalkonium chloride in aqueous samples by FTIR spectroscopy in tandem with chemometrics

Asghari, Ahmad and Adl, Alireza and ghajarbeygi, peyman and Darzi, Sina (2021) Rapid Determination of Benzalkonium chloride in aqueous samples by FTIR spectroscopy in tandem with chemometrics. Infrared Physics & Technology, 116. ISSN 1350-4495, 1879-0275

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Abstract

In this research, a powerful regression model coupled with FTIR spectroscopy (Mid, 800-1700 cm-1) has been proposed as an efficient method for precise determination of Benzalkonium chloride (BAK) in aqueous samples. For this purpose, both partial least squares regression (PLSR) and support vector regression (SVR) as methods of multivariate calibration were used for evaluation, and their results were compared. Accordingly, root mean square error of prediction, and leave-one-out cross-validation root mean square error, and correlation coefficients between the calculated ( R2 ) and the predicted ( ) values were used. In comparison to PLS (

Item Type:	Article
Subjects:	Q Science > QD Chemistry R Medicine > RN Health > RN1001 Public Health
Divisions:	University Portal > research center > hpsr
Depositing User:	pr hpsr research center
Date Deposited:	19 Sep 2021 04:02
Last Modified:	19 Sep 2021 04:02
URI:	http://eprints.qums.ac.ir/id/eprint/11039

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