The Scientific Committee for Cosmetics and NonFood Products in the 7th Amendment to the European Cosmetics Directive established 26 fragrance components, widely used in cosmetic products, as being responsible for a series of contact allergies (Directive 2003/15/EC, Official Journal of the European Union, L66/26, 11.3.2003). The regulation foresees that any allergen, present in excess of 100 mg/kg in rinse-off and of 10 mg/kg in leave-on formulations, must be reported on the label of the product. The present research reports a fast GC-full scan quadrupole mass spectrometric method (under 5 min) for the qualitative/quantitative analysis of allergens in perfumes. Reliable peak identification was achieved through a twin-filtered MS library matching procedure, considering a minimum degree of spectral similarity (90%) and retention data (a linear retention index window was applied). Peak quantification was carried out by using a specific extracted ion. In case a suspected allergen fell within its retention time window but presented a low degree of spectral purity (< 90%), analyte determination was achieved by using three extracted ions (one quantifier and two qualifiers). The fast GC-MS method was validated in terms of intraday retention time and peak area precision, LODs and LOQs, and method linearity. Finally, peak skewing was also evaluated and was within more than acceptable limits.
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http://dx.doi.org/10.1002/jssc.200600541 | DOI Listing |
Rev Sci Instrum
January 2025
National Key Laboratory of Science and Technology on Advanced Laser and High Power Microwave, Institute of Applied Electronics, China Academy of Engineering Physics, Mianyang 621900, China.
The Chinese Academy of Engineering Physics Terahertz Free Electron Laser Facility (CAEP THz FEL, CTFEL) has been operated as a user facility for over five years. To further meet the growing demands of modern science, an upgrade project for an infrared-terahertz free electron laser facility based on CTFEL has been proposed to broaden the frequency range from 0.1-4.
View Article and Find Full Text PDFJ Pharm Anal
October 2024
National Key Laboratory of Chinese Medicine Modernization, State Key Laboratory of Component-based Chinese Medicine, Tianjin University of Traditional Chinese Medicine, Tianjin, 301617, China.
Identifying the compound formulae-related xenobiotics in bio-samples is full of challenges. Conventional strategies always exhibit the insufficiencies in overall coverage, analytical efficiency, and degree of automation, and the results highly rely on the personal knowledge and experience. The goal of this work was to establish a software-aided approach, by integrating ultra-high performance liquid chromatography/ion-mobility quadrupole time-of-flight mass spectrometry (UHPLC/IM-QTOF-MS) and in-house high-definition MS library, to enhance the identification of prototypes and metabolites of the compound formulae , taking Sishen formula (SSF) as a template.
View Article and Find Full Text PDFZhongguo Zhong Yao Za Zhi
September 2024
School of Pharmacy, Nanjing University of Chinese Medicine Nanjing 210023, China State Key Laboratory for Quality Ensurance and Sustainable Use of Dao-di Herbs, National Resource Center for Chinese Materia Medica, China Academy of Chinese Medical Sciences Beijing 100700, China.
Ultra-high performance liquid chromatography with quadrupole time-of-flight mass spectrometry(UPLC-Q-TOF-MS), UNIFI software, and a self-built compound library of Longxuejie Capsules were employed to analyze the pharmacodynamic substances of Longxuejie Capsules and the metabolites in rats. The methanol extracts of capsule contents as well as the plasma, urine, and fecal metabolites of rats after drug administration were prepared. Data were collected in both positive and negative MS~E Continuum scan modes via UPLC-Q-TOF-MS.
View Article and Find Full Text PDFJ Sep Sci
December 2024
Department of Laboratory Medicine, Qingdao Hospital, University of Health and Rehabilitation Sciences (Qingdao Municipal Hospital), Qingdao, P. R. China.
Sweroside, a natural secoiridoid glycoside derived from various medicinal plants, is known for its anti-tumor, anti-inflammatory, and hepatoprotective properties. However, its pharmacological significance is not fully supported by its low systemic exposure. In this study, a de novo strategy was proposed to investigate the metabolism of sweroside in rats, including drug administration, sample pretreatment, ultra-high-performance liquid chromatography/Quadrupole-Exactive mass spectrometry data acquisition, data processing, and semi-quantitative analysis.
View Article and Find Full Text PDFAnal Chem
December 2024
Department of Analytical Chemistry, University of Pardubice, Faculty of Chemical Technology, Studentská 573, Pardubice 53210, Czech Republic.
Multidimensional chromatography offers enhanced chromatographic resolution and peak capacity, which are crucial for analyzing complex samples. This study presents a novel comprehensive online multidimensional chromatography method for the lipidomic analysis of biological samples, combining lipid class and lipid species separation approaches. The method combines optimized reversed-phase ultrahigh-performance liquid chromatography (RP-UHPLC) in the first dimension, utilizing a 150 mm long C18 column, with ultrahigh-performance supercritical fluid chromatography (UHPSFC) in the second dimension, using a 10 mm long silica column, both with sub-2 μm particles.
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