Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C5H9NO2S/c6-9(7,8)5-1-4(2-5)3-5/h4H,1-3H2,(H2,6,7,8)
SMILES NS(=O)(=O)C12CC(C1)C2
InChI Key VSGFXWVXQMJJKN-UHFFFAOYSA-N
Molecular Formula C5H9NO2S
Exact Mass 147.195 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VSGFXWVXQMJJKN-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/VSGFXWVXQMJJKN-UHFFFAOYSA-N/CHMO0000595
Version
Author Robin Bär
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-17
Related Molecule
  • bicyclo[1.1.1]pentane-1-sulfonamide
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145926355 PubChem
    The data in this table is sourced from UniChem at EBI.