Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C20H18N2OS/c23-24(18-6-2-1-3-7-18,20-12-15(13-20)14-20)22-17-8-9-19-16(11-17)5-4-10-21-19/h1-11,15H,12-14H2
SMILES O=S(=Nc1ccc2c(c1)cccn2)(C12CC(C1)C2)c1ccccc1
InChI Key FNQRKUPPIUXLJL-UHFFFAOYSA-N
Molecular Formula C20H18N2OS
Exact Mass 334.435 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FNQRKUPPIUXLJL-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/FNQRKUPPIUXLJL-UHFFFAOYSA-N/CHMO0000595
Version
Author Lukas Langer
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-17
Related Molecule
  • 1-bicyclo[1.1.1]pentanyl-oxo-phenyl-quinolin-6-ylimino-lambda6-sulfane
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145926372 PubChem
    The data in this table is sourced from UniChem at EBI.