Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Info

molecular Image
InChI InChI=1S/C24H19NO3S/c1-3-27-22-21(24(26)28-4-2)29-23(25-22)18-13-11-16-9-8-14-6-5-7-15-10-12-17(18)20(16)19(14)15/h5-13H,3-4H2,1-2H3
SMILES CCOC(=O)c1sc(nc1OCC)c1ccc2c3c1ccc1c3c(cc2)ccc1
InChI Key UNKMLDXSYNSOMA-UHFFFAOYSA-N
Molecular Formula C24H19NO3S
Exact Mass 401.478 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UNKMLDXSYNSOMA-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/UNKMLDXSYNSOMA-UHFFFAOYSA-N/CHMO0000595
Version
Author Uwe Ritter
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T05:11:17.618898
MetadataModified 2024-09-07T20:35:57.534147
MetadataPublished 2021-10-07
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
156612933 PubChem
The data in this table is sourced from UniChem at EBI.