Dataset

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

Chemical Information

InChI	InChI=1S/C22H12Br2O4/c23-17-8-2-6-15(11-17)21(27)19(25)13-4-1-5-14(10-13)20(26)22(28)16-7-3-9-18(24)12-16/h1-12H
SMILES	Brc1cccc(c1)C(=O)C(=O)c1cccc(c1)C(=O)C(=O)c1cccc(c1)Br
InChI Key	KVEKOWWMRQINJF-UHFFFAOYSA-N
Exact Mass	500.136 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/KVEKOWWMRQINJF-UHFFFAOYSA-N/CHMO0001146
License URL
Source	https://www.chemotion-repository.net/inchikey/KVEKOWWMRQINJF-UHFFFAOYSA-N/CHMO0001146
Version
Author	Sarah Wulff
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2026-02-03
Related Molecule

Field	Value
Measurement Technique	1H–13C heteronuclear single quantum coherence
Measurement Variables	date : 2025-06-15 starting time : 04:04:10 UTC creator : Aleksandra Vranic label : AVC-683 id : 358609 Solvent : CDCl3 temperature : 298.0257 K PULPROG : hsqcedetgpsisp2.3 number of scans : 4 scans instrument : Avance NEO Name : TopSpin

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