Dataset

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

Chemical Info

InChI	InChI=1S/C24H26BrNO6/c1-27-19-11-17(12-20(28-2)23(19)31-5)26(16-9-7-15(25)8-10-16)18-13-21(29-3)24(32-6)22(14-18)30-4/h7-14H,1-6H3
SMILES	COc1c(OC)cc(cc1OC)N(c1cc(OC)c(c(c1)OC)OC)c1ccc(cc1)Br
InChI Key	CFBVVJRUTGPKDN-UHFFFAOYSA-N
Molecular Formula	C24H26BrNO6
Exact Mass	504.370 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/CFBVVJRUTGPKDN-UHFFFAOYSA-N/CHMO0001146
License URL
Source	https://www.chemotion-repository.net/inchikey/CFBVVJRUTGPKDN-UHFFFAOYSA-N/CHMO0001146
Version
Author	Steffen Otterbach
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:54:06.223662
MetadataModified	2024-09-08T01:54:06.223667
MetadataPublished	2023-11-13

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

Data-Source Molecule ID	Data-Source
169408877	PubChem
The data in this table is sourced from UniChem at EBI.