title: Dealing with the ubiquity of phthalates in the laboratory when determining plasticizers by gas chromatography/mass spectrometry and PARAFAC.
abstract: Determining plasticizers and other additives migrated from plastic materials becomes a hard task when these substances are already present in the laboratory environment. This work dealt with this drawback in the multiresidue determination of four plasticizers (2,6-di-tert-butyl-4-methyl-phenol (BHT), diisobutyl phthalate (DiBP), bis(2-ethylhexyl) adipate (DEHA) and diisononyl phthalate (DiNP)) and a UV stabilizer (benzophenone (BP)) by gas chromatography/mass spectrometry (GC/MS) using DiBP-d4 as internal standard. The ubiquity of DiBP by a non-constant leaching process in the laboratory was detected, which could not guarantee the achievement of a trustworthy quantification. To handle this, the assessment of the level of DiBP in solvent blanks having fixed the probabilities of false non-compliance (α) and false compliance (β) at 0.01 was performed. On the other hand, another special case was that of DiNP, in whose chromatogram finger peaks appear because of an array of possible C9 isomers. PARAFAC, used for the identification and quantification of all the substances, is a useful chemometric tool that enabled a more reliable determination of this analyte since no peak areas were considered but chromatographic and spectral loadings. Since phthalates may migrate from rubber latex items, an evaluation of the existence of matrix effects on the determination of the five analytes was conducted prior to an extraction with hexane from a dummy for infants. As matrix effects were present, the quantification of the compounds under study was performed following the standard addition method using PARAFAC sample loadings as response variable. As a result, the presence of BHT was confirmed, being its concentration equal to 37.87μgL(-1). Calibrations based on PARAFAC yielded the following values for the decision limit (CCα): 1.16μgL(-1) for BHT, 1.34μgL(-1) for BP, 1.84μgL(-1) for DEHA and 51.42μgL(-1) for DiNP(for α=0.05 and two replicates).
authors: Department of Chemistry, Faculty of Sciences, University of Burgos, Plaza Misael Bañuelos s/n, 09001 Burgos, Spain.
authors: M L
authors: ML
authors: Oca
authors: Department of Chemistry, Faculty of Sciences, University of Burgos, Plaza Misael Bañuelos s/n, 09001 Burgos, Spain.
authors: L
authors: L
authors: Rubio
authors: Department of Mathematics and Computation, Faculty of Sciences, University of Burgos, Plaza Misael Bañuelos s/n, 09001 Burgos, Spain.
authors: L A
authors: LA
authors: Sarabia
authors: Department of Chemistry, Faculty of Sciences, University of Burgos, Plaza Misael Bañuelos s/n, 09001 Burgos, Spain. Electronic address: mcortiz@ubu.es.
authors: M C
authors: MC
authors: Ortiz
mesh_terms: D008401:Gas Chromatography-Mass Spectrometry / Q000379:methods* / Q000592:standards; D006801:Humans; D007223:Infant; D015233:Models, Statistical; D010795:Phthalic Acids / Q000737:chemistry*; D010968:Plasticizers / Q000737:chemistry*
chemical_list: D010795:Phthalic Acids; D010968:Plasticizers; C032279:phthalic acid
keywords: Benzophenone; Finger peak; PARAFAC; PTV-GC/MS; Phthalates; Plasticizers