Dataset

Quinoxyfen

This MassBank record with Accession MSBNK-UFZ-UF405501 contains the MS2 mass spectrum of Quinoxyfen with the InChIkey WRPIRSINYZBGPK-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H8Cl2FNO/c16-9-7-12(17)15-13(8-9)19-6-5-14(15)20-11-3-1-10(18)2-4-11/h1-8H
SMILES FC1=CC=C(OC2=C3C(Cl)=CC(Cl)=CC3=NC=C2)C=C1
InChI Key WRPIRSINYZBGPK-UHFFFAOYSA-N
Molecular Formula C15H8Cl2FNO
Exact Mass 306.997 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF405501
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:49:31.616431
MetadataModified 2025-02-09T19:48:34.306265
MetadataPublished 2017-01-05
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL1869863 ChEMBL
C18892 KEGG Ligand
J907.013C Nikkaji
HMDB0257055 Human Metabolome Database
DTXSID2034881 EPA CompTox Dashboard
CB7757516 ChemicalBook
ZINC000006896340 ZINC
3391107 PubChem
124495-18-7 ACToR
SCHEMBL22257 SureChEMBL
14874122 PubChem: Thomson Pharma
PPC78J1VCW FDA SRS
82040 ChEBI
PD119070 ProbesDrugs
511372 eMolecules
The data in this table is sourced from UniChem at EBI.