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

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Dataset

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

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

Chemical Information

molecular Image

InChI	InChI=1S/C12H6N2S2/c13-7-9(8-14)6-10-3-4-12(16-10)11-2-1-5-15-11/h1-6H
SMILES	N#CC(=Cc1ccc(s1)c1cccs1)C#N
InChI Key	JULWDNGPIOYHSR-UHFFFAOYSA-N
Exact Mass	242.319 g/mol

Data and Resources

1H--13C heteronuclear single quantum coherence...HTML

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Metadata Information

Field	Value
DOI	10.14272/JULWDNGPIOYHSR-UHFFFAOYSA-N/CHMO0001146
License URL
Source	https://www.chemotion-repository.net/inchikey/JULWDNGPIOYHSR-UHFFFAOYSA-N/CHMO0001146
Version
Author	Peter Bäuerle
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-12-11
Related Molecule

Field	Value
Measurement Technique	1H–13C heteronuclear single quantum coherence
Measurement Variables

Data-Source Molecule ID	Data-Source
15105974	surechembl
2739819	pubchem
LEMRAA	CCDC
Molport-002-920-734	molport
The data in this table is sourced from UniChem at EBI.