S60 | SWISSPEST19 | Swiss Pesticides and Metabolites from Kiefer et al 2019

Swiss pesticides (plant protection products) and metabolites from Kiefer et al 2019 (Eawag), Tables SI-B 1 and 2, DOI: 10.1016/j.watres.2019.114972. Dataset DOI: 10.5281/zenodo.3544759 Update 25 April 2020: fixed many naming issues in xlsx and csv file. No structural information changed. 25 Mar 2023: fixed date CAS. 25 May 2023: fixed non-live CIDs to live CIDs. 6 Jul 2023: added NOA 413161 structures and transformations file. 8 April 2025: fixed three CIDs that went non-live to match CIDs from NORMAN deposition. Mismatch of InChIKeys due to difference in treatment of the C=N-O groups between PubChem and Open Babel; files now match PubChem's output. 2 Jun 2025: updated TFA synonym. 31 Aug 2025: fixed triazole alanine structure for one entry (removing incorrect CID 139597001). 1 Apr 2026: updated non-live CIDs to live ones after PubChem changed handling.