Dataset

Ethiofencarb

This MassBank record with Accession MSBNK-Eawag-EQ01124303 contains the MS2 mass spectrum of Ethiofencarb with the InChIkey HEZNVIYQEUHLNI-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H15NO2S/c1-3-15-8-9-6-4-5-7-10(9)14-11(13)12-2/h4-7H,3,8H2,1-2H3,(H,12,13)
SMILES CCSCC1=CC=CC=C1OC(=O)NC
InChI Key HEZNVIYQEUHLNI-UHFFFAOYSA-N
Molecular Formula C11H15NO2S
Exact Mass 225.082 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-EQ01124303
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:01:44.516233
MetadataModified 2025-02-09T09:47:33.017636
MetadataPublished 2023-04-27
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
509806 eMolecules
16681831 PubChem: Thomson Pharma
34766 PubChem
29973-13-5 ACToR
SCHEMBL74938 SureChEMBL
FY0YB813XV FDA SRS
20208363 NMRShiftDB
11755 Brenda
138735 Brenda
HMDB0031782 Human Metabolome Database
50253090 BindingDB
DTXSID3037545 EPA CompTox Dashboard
ZINC000002011298 ZINC
J3.172K Nikkaji
CB0140940 ChemicalBook
CHEMBL493480 ChEMBL
38483 ChEBI
C18649 KEGG Ligand
The data in this table is sourced from UniChem at EBI.