Dataset

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

Chemical Information

InChI	InChI=1S/C32H32/c1-21-5-11-29(17-23(21)3)31-19-25-7-8-26-10-14-28(16-15-27(31)13-9-25)32(20-26)30-12-6-22(2)24(4)18-30/h5-6,9-14,17-20H,7-8,15-16H2,1-4H3
SMILES	Cc1ccc(cc1C)c1cc2ccc1CCc1ccc(CC2)cc1c1ccc(c(c1)C)C
InChI Key	BPPKDQJHKSOZQS-UHFFFAOYSA-N
Exact Mass	416.596 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/BPPKDQJHKSOZQS-UHFFFAOYSA-N/CHMO0001146
License URL
Source	https://www.chemotion-repository.net/inchikey/BPPKDQJHKSOZQS-UHFFFAOYSA-N/CHMO0001146
Version
Author	Stefan Bräse
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2026-03-23
Related Molecule

Field	Value
Measurement Technique	1H–13C heteronuclear single quantum coherence
Measurement Variables	date : 2025-08-01 starting time : 04:05:52 UTC creator : Yuting Li label : YTL-1039 id : 362120 Solvent : CDCl3 temperature : 298.033 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.