Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C13H17NO3S/c1-12-2-4-13(5-3-12)6-11-18(15,16)14-7-9-17-10-8-14/h2-6,11H,7-10H2,1H3/b11-6+
SMILES Cc1ccc(cc1)/C=C/S(=O)(=O)N1CCOCC1
InChI Key NYIYZYBSNGRSHY-IZZDOVSWSA-N
Exact Mass 267.344 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NYIYZYBSNGRSHY-IZZDOVSWSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/NYIYZYBSNGRSHY-IZZDOVSWSA-N/CHMO0000595
Version
Author Georg Manolikakes
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-08-14
Related Molecule
  • 4-[(E)-2-(4-methylphenyl)ethenyl]sulfonylmorpholine
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    176491958 pubchem
    TEMZIY CCDC
    The data in this table is sourced from UniChem at EBI.