Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C12H13NS2/c13-6-11-3-1-10(2-4-11)5-12-7-14-9-15-8-12/h1-4,12H,5,7-9H2
SMILES	N#Cc1ccc(cc1)CC1CSCSC1
InChI Key	RVVAHTWERJYRDV-UHFFFAOYSA-N
Molecular Formula	C12H13NS2
Exact Mass	235.368 g/mol

Data and Resources

• 13C nuclear magnetic resonance spectroscopy (13C NMR)HTML
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Metadata Information

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• Molecule Data-Sources

Field	Value
DOI	10.14272/RVVAHTWERJYRDV-UHFFFAOYSA-N/NMR/13C/CDCl3/125.1
License URL
Source	https://www.chemotion-repository.net/inchikey/RVVAHTWERJYRDV-UHFFFAOYSA-N/NMR/13C/CDCl3/125.1
Version
Author	Steven Susanto
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T22:20:36.927267
MetadataModified	2024-09-07T14:14:59.573206
MetadataPublished	2016-11-25

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
122398418	PubChem
The data in this table is sourced from UniChem at EBI.