Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)

Chemical Information

molecular Image
InChI InChI=1S/C17H17NO2S/c1-19-9-10-20-13-7-8-15-16(11-13)18-12-17(15)21-14-5-3-2-4-6-14/h2-8,11-12,18H,9-10H2,1H3
SMILES COCCOc1ccc2c(c1)[nH]cc2Sc1ccccc1
InChI Key CATGSNBERVFLMC-UHFFFAOYSA-N
Molecular Formula C17H17NO2S
Exact Mass 299.387 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/CATGSNBERVFLMC-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/CATGSNBERVFLMC-UHFFFAOYSA-N/CHMO0001150
Version
Author Niklas Krappel
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-07-31
Related Molecule
  • 6-(2-methoxyethoxy)-3-phenylsulfanyl-1H-indole
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    168433110 PubChem
    The data in this table is sourced from UniChem at EBI.