Chemometric Optimization of SPE for the Determination of Multiclass Pesticides in Portable Water Samples by UHPLC-MS/MS

Bull Environ Contam Toxicol. 2024 Mar 9;112(3):48. doi: 10.1007/s00128-024-03873-2.

Abstract

This study aimed on the development of a SPE-UHPLC-MS/MS method for the simultaneous determination of pesticide residues in drinking water samples. A chemometric approach was applied to optimize the efficiency of the SPE pretreatment procedure. This study involved (i) the application of a Full Factorial Design for the screening of the significant factors, (ii) the application of a Central Composite Design for the determination of the optimal conditions and (iii) the evaluation and validation of the significance of the statistically proposed models. Oasis HLB cartridges were used for the extraction. The optimum sample volume was 300 mL and the elution solvent 3 mL of the mixture of methanol:ethylacetate 70:30 v/v. The method was validated according to the international guidelines. Recoveries were ranged from 63 to 116% and the detection limits were between 0.1 and 1.5 pg mL- 1. The validated method could be used in routine analysis for pesticides screening.

Keywords: Central composite design (CCD); Design of experiments; Pesticides; Solid phase extraction (SPE); UHPLC-MS/MS.

MeSH terms

  • Chemometrics
  • Chromatography, High Pressure Liquid / methods
  • Pesticides* / analysis
  • Solid Phase Extraction / methods
  • Tandem Mass Spectrometry / methods
  • Water

Substances

  • Pesticides
  • Water