Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C6H11NOS/c1-9(7,8)6-2-5(3-6)4-6/h5,7H,2-4H2,1H3
SMILES CS(=O)(=N)C12CC(C1)C2
InChI Key KBKAKKSPPNJJTH-UHFFFAOYSA-N
Molecular Formula C6H11NOS
Exact Mass 145.223 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/KBKAKKSPPNJJTH-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/KBKAKKSPPNJJTH-UHFFFAOYSA-N/CHMO0000595
Version
Author Lukas Langer
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-09-19
Related Molecule
  • 1-bicyclo[1.1.1]pentanyl-imino-methyl-oxo-lambda6-sulfane
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    165941990 pubchem
    The data in this table is sourced from UniChem at EBI.