Dataset

Fluensulfone

This MassBank record with Accession MSBNK-Eawag-EQ01136902 contains the MS2 mass spectrum of Fluensulfone with the InChIkey XSNMWAPKHUGZGQ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C7H5ClF3NO2S2/c8-5-3-12-7(15-5)16(13,14)2-1-4(9)6(10)11/h3H,1-2H2
SMILES C1=C(SC(=N1)S(=O)(=O)CCC(=C(F)F)F)Cl
InChI Key XSNMWAPKHUGZGQ-UHFFFAOYSA-N
Molecular Formula C7H5ClF3NO2S2
Exact Mass 290.940 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-EQ01136902
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T13:32:11.614956
MetadataModified 2025-02-09T09:54:14.939350
MetadataPublished 2023-04-27
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
ZINC000077292637 ZINC
CB22622679 ChemicalBook
J2.771.050F Nikkaji
131597 ChEBI
DTXSID1058054 EPA CompTox Dashboard
HY-107771 MedChemExpress
11534927 PubChem
SCHEMBL174908 SureChEMBL
PD056483 ProbesDrugs
I7V6200877 FDA SRS
16934590 PubChem: Thomson Pharma
The data in this table is sourced from UniChem at EBI.