Dataset

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

Chemical Info

InChI	InChI=1S/C34H34N3.3HI/c1-35-16-10-27(11-17-35)32-22-25-4-6-26(32)8-9-31-24-33(28-12-18-36(2)19-13-28)30(7-5-25)23-34(31)29-14-20-37(3)21-15-29;;;/h4,6,10-24H,5,7-9H2,1-3H3;3*1H/q+3;;;/p-3
SMILES	C[n+]1ccc(cc1)c1cc2CCc3ccc(CCc1cc2c1cc[n+](cc1)C)c(c3)c1cc[n+](cc1)C.[I-].[I-].[I-]
InChI Key	JOPKLEIRDAALPY-UHFFFAOYSA-K
Molecular Formula	C34H34I3N3
Exact Mass	865.367 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement

Field	Value
DOI	10.14272/JOPKLEIRDAALPY-UHFFFAOYSA-K/CHMO0001146.1
License URL
Source	https://www.chemotion-repository.net/inchikey/JOPKLEIRDAALPY-UHFFFAOYSA-K/CHMO0001146.1
Version
Author	Yichuan Wang
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T04:07:10.186707
MetadataModified	2024-09-08T04:07:10.186711
MetadataPublished	2024-07-10

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