S79 | UACCSCEC | Collision Cross Section Library from UAntwerp

publishedv1Published Jul 25, 2026

Overview

A collection of compounds, metabolites, and transformation-product relationships associated with the University of Antwerp collision cross section library. The dataset supports ion-mobility and high-resolution mass-spectrometry identification of contaminants of emerging concern and related transformation products.

Authors

Lidia Belova Noelia Caballero-Casero Alexander L. N. van Nuijs Adrian Covaci

Keywords

CCS collision cross section emerging contaminants HRMS ion mobility metabolites transformation products

Statistics

Compounds

Published reactions

Unique compound connections

Predecessors

Successors

Version history

Every version stays downloadable as CSV; only the current version is active in the public graph.

Version 1(viewing)
Published Jul 25, 2026 · 30 reaction(s)
Current
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Identifiers & references

Dataset reference

Belova, L.; Caballero-Casero, N.; van Nuijs, A. L. N.; Covaci, A. S79 | UACCSCEC | Collision Cross Section Library from UAntwerp. Zenodo. DOI: 10.5281/zenodo.4704648.

Dataset DOI: 10.5281/zenodo.4704648
Publication DOI: 10.1021/acs.analchem.1c00142