Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C11H13NOS/c12-14(13,10-4-2-1-3-5-10)11-6-9(7-11)8-11/h1-5,9,12H,6-8H2
SMILES N=S(=O)(C12CC(C1)C2)c1ccccc1
InChI Key NEKGDCIKXKJMQB-UHFFFAOYSA-N
Molecular Formula C11H13NOS
Exact Mass 207.292 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NEKGDCIKXKJMQB-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/NEKGDCIKXKJMQB-UHFFFAOYSA-N/CHMO0000595
Version
Author Robin Bär
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-17
Related Molecule
  • 1-bicyclo[1.1.1]pentanyl-imino-oxo-phenyl-lambda6-sulfane
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145926348 PubChem
    The data in this table is sourced from UniChem at EBI.