Dataset

distortionless enhancement with polarization transfer (DEPT)

Chemical Information

InChI	InChI=1S/C30H12Br6S6/c31-19-7-1-13(37-19)25-26(14-2-8-20(32)38-14)28(16-4-10-22(34)40-16)30(18-6-12-24(36)42-18)29(17-5-11-23(35)41-17)27(25)15-3-9-21(33)39-15/h1-12H
SMILES	Brc1ccc(s1)c1c(c2ccc(s2)Br)c(c2ccc(s2)Br)c(c(c1c1ccc(s1)Br)c1ccc(s1)Br)c1ccc(s1)Br
InChI Key	YSDMWPXYHKHPEB-UHFFFAOYSA-N
Exact Mass	1044.230 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/YSDMWPXYHKHPEB-UHFFFAOYSA-N/CHMO0000596
License URL
Source	https://www.chemotion-repository.net/inchikey/YSDMWPXYHKHPEB-UHFFFAOYSA-N/CHMO0000596
Version
Author	Peter Bäuerle
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-12-11
Related Molecule

Field	Value
Measurement Technique	distortionless enhancement with polarization transfer
Measurement Variables	Date : 2025-12-01 Start time : 18:48:28 UTC Creator : Sylvia Vanderheiden-Schroen Label : ComP-27237 ID : 354065 Solvent : CDCl3 Temperature : 298.001025179352 K K Puls programme : deptsp90 Number of scans : 256 Instrument : Avance NEO 400 Name : TopSpin

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