Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

Chemical Info

InChI	InChI=1S/C12H12N2S/c1-15-12-6-4-10(5-7-12)14-9-11-3-2-8-13-11/h2-9,13H,1H3/b14-9+
SMILES	CSc1ccc(cc1)/N=C/c1ccc[nH]1
InChI Key	KYQMJVXFEUZCLO-NTEUORMPSA-N
Exact Mass	216.302 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/KYQMJVXFEUZCLO-NTEUORMPSA-N/CHMO0001146
License URL
Source	https://www.chemotion-repository.net/inchikey/KYQMJVXFEUZCLO-NTEUORMPSA-N/CHMO0001146
Version
Author	Valentina Ferraro
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T03:18:12.502838
MetadataModified	2024-09-23T09:22:52.660590
MetadataPublished	2024-04-17

Field	Value
Measurement Technique	1H–13C heteronuclear single quantum coherence
Measurement Variables	temperature : 298.0 K PULPROG : hsqcedetgpsisp2.3 number of scans : 8 scans title : Oct27-2023-braese date : 20231027 starting time : 4.20 h instrument : spect label : VF-194 id : 106398 Solvent : chloroform-D1 (CDCl3)

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.