Dataset

Flufenacet-OXA

This MassBank record with Accession MSBNK-Athens_Univ-AU205502 contains the MS2 mass spectrum of Flufenacet-OXA with the InChIkey FFKNXXCOXIZLJD-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H12FNO3/c1-7(2)13(10(14)11(15)16)9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H,15,16)
SMILES CC(C)N(C(=O)C(O)=O)C1=CC=C(F)C=C1
InChI Key FFKNXXCOXIZLJD-UHFFFAOYSA-N
Molecular Formula C11H12FNO3
Exact Mass 225.080 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-Athens_Univ-AU205502
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:46:24.116443
MetadataModified 2025-02-08T19:10:06.850581
MetadataPublished 2015-12-03
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
201668-31-7 ACToR
24281261 eMolecules
83474 ChEBI
ZINC000043215005 ZINC
DTXSID2037552 EPA CompTox Dashboard
MHK948F670 FDA SRS
J1.704.093F Nikkaji
16212222 PubChem
The data in this table is sourced from UniChem at EBI.