Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C14H17NO5S/c1-12(16)20-14-4-2-13(3-5-14)6-11-21(17,18)15-7-9-19-10-8-15/h2-6,11H,7-10H2,1H3/b11-6+
SMILES CC(=O)Oc1ccc(cc1)/C=C/S(=O)(=O)N1CCOCC1
InChI Key HOQLEZAFYZRYDA-IZZDOVSWSA-N
Exact Mass 311.353 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HOQLEZAFYZRYDA-IZZDOVSWSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/HOQLEZAFYZRYDA-IZZDOVSWSA-N/CHMO0000595
Version
Author Georg Manolikakes
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-08-14
Related Molecule
  • [4-[(E)-2-morpholin-4-ylsulfonylethenyl]phenyl] acetate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    176491944 pubchem
    The data in this table is sourced from UniChem at EBI.