Dataset

Thiometon; LC-ESI-QFT; MS2; CE: 45%; R=17500; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01140703 contains the MS2 mass spectrum of Thiometon with the InChIkey OPASCBHCTNRLRM-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C6H15O2PS3/c1-4-11-5-6-12-9(10,7-2)8-3/h4-6H2,1-3H3
SMILES CCSCCSP(=S)(OC)OC
InChI Key OPASCBHCTNRLRM-UHFFFAOYSA-N
Molecular Formula C6H15O2PS3
Exact Mass 245.997 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-EQ01140703
Version
Author
Maintainer
Language
MetadataPublished 2023-04-27
Related Molecule
  • 2-ethylsulfanylethylsulfanyl-dimethoxy-sulfanylidene-lambda5-phosphane
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:38962 chebi
    73162 surechembl
    12541 pubchem
    YDI0MXQ7IR fdasrs
    HMDB0259016 hmdb
    The data in this table is sourced from UniChem at EBI.