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/C4H6S3/c5-4-6-2-1-3-7-4/h1-3H2
SMILES S=C1SCCCS1
InChI Key BVNLWJVULAZODX-UHFFFAOYSA-N
Molecular Formula C4H6S3
Exact Mass 150.285 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BVNLWJVULAZODX-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
License URL
Source https://www.chemotion-repository.net/inchikey/BVNLWJVULAZODX-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
Version
Author Steven Susanto
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T22:17:58.476665
MetadataModified 2024-09-07T14:10:43.299749
MetadataPublished 2015-10-31
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL2159449 SureChEMBL
15995374 PubChem: Thomson Pharma
1748-15-8 ACToR
137194 PubChem
DTXSID60169900 EPA CompTox Dashboard
ZINC000001672774 ZINC
PUVVUZ CCDC
J579G Nikkaji
The data in this table is sourced from UniChem at EBI.