Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C14H16OS2/c1-11(15)7-8-13(14-16-9-10-17-14)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3
SMILES CC(=O)CCC(=C1SCCS1)c1ccccc1
InChI Key LXKWSUYFYQCLRX-UHFFFAOYSA-N
Molecular Formula C14H16OS2
Exact Mass 264.406 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LXKWSUYFYQCLRX-UHFFFAOYSA-N/13CNMR
License URL
Source https://www.chemotion-repository.net/inchikey/LXKWSUYFYQCLRX-UHFFFAOYSA-N/13CNMR
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2018-04-27
Related Molecule
  • 5-(1,3-dithiolan-2-ylidene)-5-phenylpentan-2-one
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    133053727 PubChem
    The data in this table is sourced from UniChem at EBI.