Dataset

elemental analysis (EA)

dataset for elemental analysis (EA)

Chemical Information

molecular Image
InChI InChI=1S/C11H14O2S2/c1-12-9-4-3-8(7-10(9)13-2)11-14-5-6-15-11/h3-4,7,11H,5-6H2,1-2H3
SMILES COc1cc(ccc1OC)C1SCCS1
InChI Key GCEOBMQOSMEWSN-UHFFFAOYSA-N
Molecular Formula C11H14O2S2
Exact Mass 242.358 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GCEOBMQOSMEWSN-UHFFFAOYSA-N/CHMO0001075
License URL
Source https://www.chemotion-repository.net/inchikey/GCEOBMQOSMEWSN-UHFFFAOYSA-N/CHMO0001075
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-06-16
Related Molecule
  • 2-(3,4-dimethoxyphenyl)-1,3-dithiolane
    • Field Value
    Measurement Technique elemental analysis
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DTXSID00220201 EPA CompTox Dashboard
    MCULE-2019595360 Mcule
    J91.150J Nikkaji
    69922-36-7 ACToR
    SCHEMBL9778828 SureChEMBL
    50928 PubChem
    The data in this table is sourced from UniChem at EBI.