Dataset

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

Chemical Information

InChI	InChI=1S/C22H18BrNO4/c1-27-21(25)18-13-15(23)14-19(22(26)28-2)20(18)24(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-14H,1-2H3
SMILES	COC(=O)c1cc(Br)cc(c1N(c1ccccc1)c1ccccc1)C(=O)OC
InChI Key	GOTFTQVRCXURLK-UHFFFAOYSA-N
Exact Mass	440.287 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/GOTFTQVRCXURLK-UHFFFAOYSA-N/CHMO0001146
License URL
Source	https://www.chemotion-repository.net/inchikey/GOTFTQVRCXURLK-UHFFFAOYSA-N/CHMO0001146
Version
Author	Janine Haug
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-09-16
Related Molecule

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

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