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/C6H10O2S2/c1-8-6(7)5-2-9-4-10-3-5/h5H,2-4H2,1H3
SMILES COC(=O)C1CSCSC1
InChI Key BNEXDOXCTGRPIX-UHFFFAOYSA-N
Molecular Formula C6H10O2S2
Exact Mass 178.272 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BNEXDOXCTGRPIX-UHFFFAOYSA-N/13CNMR
License URL
Source https://www.chemotion-repository.net/inchikey/BNEXDOXCTGRPIX-UHFFFAOYSA-N/13CNMR
Version
Author Steven Susanto
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T00:46:17.351332
MetadataModified 2024-09-07T14:38:16.400873
MetadataPublished 2019-01-21
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
71745908 PubChem
SCHEMBL1866148 SureChEMBL
The data in this table is sourced from UniChem at EBI.