Aarhus University Seal

Inter-laboratory mass spectrometry dataset based on passive sampling of drinking water for non-target analysis

Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  • Bastian Schulze, University of Queensland
  • ,
  • Denice van Herwerden, University of Amsterdam
  • ,
  • Ian Allan, Norwegian Institute for Water Research
  • ,
  • Lubertus Bijlsma, Jaume I University
  • ,
  • Nestor Etxebarria, University of the Basque Country
  • ,
  • Martin Hansen
  • Sylvain Merel, Irstea
  • ,
  • Branislav Vrana, Masaryk University
  • ,
  • Reza Aalizadeh, University of Athens
  • ,
  • Bernard Bajema, Vitens N.V.
  • ,
  • Florian Dubocq, Örebro University
  • ,
  • Gianluca Coppola, Eurolab Srl
  • ,
  • Aurélie Fildier, Universite Claude Bernard Lyon 1
  • ,
  • Pavla Fialová, Masaryk University
  • ,
  • Emil Frøkjær
  • Roman Grabic, University of South Bohemia
  • ,
  • Pablo Gago-Ferrero, University of Girona
  • ,
  • Thorsten Gravert
  • ,
  • Juliane Hollender, Swiss Federal Institute of Aquatic Science and Technology
  • ,
  • Nina Huynh, Universite Paris XII
  • ,
  • Griet Jacobs, Flemish Institute for Technological Research
  • ,
  • Tim Jonkers, Vrije Universiteit Amsterdam
  • ,
  • Sarit Kaserzon, University of Queensland
  • ,
  • Marja Lamoree, Vrije Universiteit Amsterdam
  • ,
  • Julien Le Roux, Universite Paris XII
  • ,
  • Teresa Mairinger, Swiss Federal Institute of Aquatic Science and Technology, University of Natural Resources and Life Sciences, Vienna
  • ,
  • Christelle Margoum, Irstea
  • ,
  • Giuseppe Mascolo, CNR
  • ,
  • Emmanuelle Mebold, Universite Paris XII
  • ,
  • Frank Menger, Swedish University of Agricultural Sciences
  • ,
  • Cécile Miège, Irstea
  • ,
  • Jeroen Meijer, Vrije Universiteit Amsterdam
  • ,
  • Régis Moilleron, Universite Paris XII
  • ,
  • Sapia Murgolo, CNR
  • ,
  • Massimo Peruzzo, Universite Claude Bernard Lyon 1
  • ,
  • Martijn Pijnappels, Rijkswaterstaat
  • ,
  • Malcolm Reid, Norwegian Institute for Water Research
  • ,
  • Claudio Roscioli, CNR
  • ,
  • Coralie Soulier, BRGM
  • ,
  • Sara Valsecchi, CNR
  • ,
  • Nikolaos Thomaidis, University of Athens
  • ,
  • Emmanuelle Vulliet, Örebro University
  • ,
  • Robert Young, Colorado State University
  • ,
  • Saer Samanipour, University of Amsterdam, Norwegian Institute for Water Research

Non-target analysis (NTA) employing high-resolution mass spectrometry is a commonly applied approach for the detection of novel chemicals of emerging concern in complex environmental samples. NTA typically results in large and information-rich datasets that require computer aided (ideally automated) strategies for their processing and interpretation. Such strategies do however raise the challenge of reproducibility between and within different processing workflows. An effective strategy to mitigate such problems is the implementation of inter-laboratory studies (ILS) with the aim to evaluate different workflows and agree on harmonized/standardized quality control procedures. Here we present the data generated during such an ILS. This study was organized through the Norman Network and included 21 participants from 11 countries. A set of samples based on the passive sampling of drinking water pre and post treatment was shipped to all the participating laboratories for analysis, using one pre-defined method and one locally (i.e. in-house) developed method. The data generated represents a valuable resource (i.e. benchmark) for future developments of algorithms and workflows for NTA experiments.

Original languageEnglish
Article number223
JournalScientific Data
Volume8
Issue1
ISSN2052-4463
DOIs
Publication statusPublished - Dec 2021

Bibliographical note

Publisher Copyright:
© 2021, The Author(s).

See relations at Aarhus University Citationformats

ID: 222474734