Ontology highlight
ABSTRACT:
INSTRUMENT(S): Q Exactive
ORGANISM(S): Na
SUBMITTER: Jeremy Paul Koelmel John A. Bowden
PROVIDER: MSV000091594 | MassIVE | Thu Mar 30 11:43:00 BST 2023
REPOSITORIES: MassIVE
Koelmel Jeremy P JP Paige Matthew K MK Aristizabal-Henao Juan J JJ Robey Nicole M NM Nason Sara L SL Stelben Paul J PJ Li Yang Y Kroeger Nicholas M NM Napolitano Michael P MP Savvaides Tina T Vasiliou Vasilis V Rostkowski Pawel P Garrett Timothy J TJ Lin Elizabeth E Deigl Chris C Jobst Karl K Townsend Timothy G TG Godri Pollitt Krystal J KJ Bowden John A JA
Analytical chemistry 20200806 16
Thousands of per- and polyfluoroalkyl substances (PFAS) exist in the environment and pose a potential health hazard. Suspect and nontarget screening with liquid chromatography (LC)-high-resolution tandem mass spectrometry (HRMS/MS) can be used for comprehensive characterization of PFAS. To date, no automated open source PFAS data analysis software exists to mine these extensive data sets. We introduce FluoroMatch, which automates file conversion, chromatographic peak picking, blank feature filte ...[more]