Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C12H15NO2S/c14-16(15,12-6-11(7-12)8-12)13-9-10-4-2-1-3-5-10/h1-5,11,13H,6-9H2
SMILES O=S(=O)(C12CC(C1)C2)NCc1ccccc1
InChI Key HDEKBUQPCJOEAM-UHFFFAOYSA-N
Molecular Formula C12H15NO2S
Exact Mass 237.318 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HDEKBUQPCJOEAM-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/HDEKBUQPCJOEAM-UHFFFAOYSA-N/CHMO0000595
Version
Author Martin Nieger
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-17
Related Molecule
  • N-benzylbicyclo[1.1.1]pentane-1-sulfonamide
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145926354 PubChem
    The data in this table is sourced from UniChem at EBI.