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/C15H15NS2/c1-3-13-4-2-12(1)8-17-10-14-5-6-15(16-7-14)11-18-9-13/h1-7H,8-11H2
SMILES S1Cc2ccc(cc2)CSCc2ccc(C1)cn2
InChI Key BAXAMMQJEIFHAB-UHFFFAOYSA-N
Molecular Formula C15H15NS2
Exact Mass 273.416 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BAXAMMQJEIFHAB-UHFFFAOYSA-N/NMR/13C/CDCl3/100
License URL
Source https://www.chemotion-repository.net/inchikey/BAXAMMQJEIFHAB-UHFFFAOYSA-N/NMR/13C/CDCl3/100
Version
Author Joshua Kramer
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T23:50:10.190387
MetadataModified 2024-09-07T13:11:21.841095
MetadataPublished 2014-05-27
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
15470610 PubChem
GALRIX CCDC
J1.139.416G Nikkaji
The data in this table is sourced from UniChem at EBI.