Dataset

Methiocarb; LC-ESI-QTOF; MS2; 80 V

This MassBank record with Accession MSBNK-BAFG-CSL23111027294 contains the MS2 mass spectrum of Methiocarb with the InChIkey YFBPRJGDJKVWAH-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)
SMILES Cc1cc(cc(c1SC)C)OC(=O)NC
InChI Key YFBPRJGDJKVWAH-UHFFFAOYSA-N
Molecular Formula C11H15NO2S
Exact Mass 225.082 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL23111027294
Version
Author
Maintainer
Language
MetadataPublished 2023-11-10
Related Molecule
  • (3,5-dimethyl-4-methylsulfanylphenyl) N-methylcarbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:38508 chebi
    CHEMBL1076495 chembl
    24740 surechembl
    16248 pubchem
    JI9431OS31 fdasrs
    PD085525 probes_and_drugs
    MESURO CCDC
    14081 brenda
    HMDB0254529 hmdb
    The data in this table is sourced from UniChem at EBI.