Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C19H20S2/c1-14-3-7-16(8-4-14)20-18-11-19(12-18,13-18)21-17-9-5-15(2)6-10-17/h3-10H,11-13H2,1-2H3
SMILES Cc1ccc(cc1)SC12CC(C1)(C2)Sc1ccc(cc1)C
InChI Key NZNGNSDNZKZZOJ-UHFFFAOYSA-N
Molecular Formula C19H20S2
Exact Mass 312.492 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NZNGNSDNZKZZOJ-UHFFFAOYSA-N/13CNMR
License URL
Source https://www.chemotion-repository.net/inchikey/NZNGNSDNZKZZOJ-UHFFFAOYSA-N/13CNMR
Version
Author Robin Bär
Maintainer Chemotion Repository
Language english
MetadataPublished 2019-02-01
Related Molecule
  • 1,3-bis[(4-methylphenyl)sulfanyl]bicyclo[1.1.1]pentane
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    137321625 pubchem
    The data in this table is sourced from UniChem at EBI.