Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C13H17NO2S/c1-14(10-11-5-3-2-4-6-11)17(15,16)13-7-12(8-13)9-13/h2-6,12H,7-10H2,1H3
SMILES CN(S(=O)(=O)C12CC(C1)C2)Cc1ccccc1
InChI Key WTYCRMZWTGSRSJ-UHFFFAOYSA-N
Molecular Formula C13H17NO2S
Exact Mass 251.345 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WTYCRMZWTGSRSJ-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/WTYCRMZWTGSRSJ-UHFFFAOYSA-N/CHMO0000595
Version
Author Robin Bär
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-17
Related Molecule
  • N-benzyl-N-methylbicyclo[1.1.1]pentane-1-sulfonamide
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145926353 PubChem
    The data in this table is sourced from UniChem at EBI.