Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

InChI	InChI=1S/C36H34Br2S/c1-35(2,3)27-17-13-23(14-18-27)31-32(24-15-19-28(20-16-24)36(4,5)6)34(26-10-8-12-30(38)22-26)39-33(31)25-9-7-11-29(37)21-25/h7-22H,1-6H3
SMILES	Brc1cccc(c1)c1sc(c(c1c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)c1cccc(c1)Br
InChI Key	JUBNQTRRCMJNOK-UHFFFAOYSA-N
Exact Mass	658.528 g/mol

Data and Resources

• 13C nuclear magnetic resonance spectroscopy (13C NMR)HTML
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• 13c-nuclear-magneti...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/JUBNQTRRCMJNOK-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/JUBNQTRRCMJNOK-UHFFFAOYSA-N/CHMO0000595
Version
Author	Peter Bäuerle
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-12-11
Related Molecule

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables

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