Dataset

Ethiofencarb; LC-ESI-QFT; MS2; CE: 120%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01124307 contains the MS2 mass spectrum of Ethiofencarb with the InChIkey HEZNVIYQEUHLNI-UHFFFAOYSA-N.

Chemical Information

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-EQ01124307
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MetadataPublished 2023-04-27
Related Molecule
  • [2-(ethylsulfanylmethyl)phenyl] N-methylcarbamate
    • 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.