Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C6H10O2S/c1-9(7,8)6-2-5(3-6)4-6/h5H,2-4H2,1H3
SMILES CS(=O)(=O)C12CC(C1)C2
InChI Key FSXICMNLRKENOE-UHFFFAOYSA-N
Molecular Formula C6H10O2S
Exact Mass 146.207 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FSXICMNLRKENOE-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/FSXICMNLRKENOE-UHFFFAOYSA-N/CHMO0000595
Version
Author Martin Nieger
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-17
Related Molecule
  • 1-methylsulfonylbicyclo[1.1.1]pentane
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    SCHEMBL17586303 SureChEMBL
    118941229 PubChem
    The data in this table is sourced from UniChem at EBI.