Dataset

Fenfuram

This MassBank record with Accession MSBNK-Eawag-EQ01125009 contains the MS2 mass spectrum of Fenfuram with the InChIkey JFSPBVWPKOEZCB-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H11NO2/c1-9-11(7-8-15-9)12(14)13-10-5-3-2-4-6-10/h2-8H,1H3,(H,13,14)
SMILES CC1=C(C=CO1)C(=O)NC2=CC=CC=C2
InChI Key JFSPBVWPKOEZCB-UHFFFAOYSA-N
Molecular Formula C12H11NO2
Exact Mass 201.079 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01125009
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:20:11.387676
MetadataModified 2025-02-09T09:58:27.276997
MetadataPublished 2023-04-27
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
C18833 KEGG Ligand
J20.320C Nikkaji
ZINC000002169427 ZINC
DTXSID8058035 EPA CompTox Dashboard
CB6150985 ChemicalBook
CHEMBL1862959 ChEMBL
MCULE-3624819589 Mcule
SCHEMBL18978 SureChEMBL
217136 Brenda
90590 PubChem
81994 ChEBI
16582226 PubChem: Thomson Pharma
24691-80-3 ACToR
71724-31-7 ACToR
5RCI1Z8OVH FDA SRS
509840 eMolecules
The data in this table is sourced from UniChem at EBI.