Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

InChI	InChI=1S/C32H18S8/c1-5-23(33-13-1)29-17-19(31(39-29)27-7-3-15-35-27)21-9-11-25(37-21)26-12-10-22(38-26)20-18-30(24-6-2-14-34-24)40-32(20)28-8-4-16-36-28/h1-18H
SMILES	c1csc(c1)c1sc(cc1c1ccc(s1)c1ccc(s1)c1cc(sc1c1cccs1)c1cccs1)c1cccs1
InChI Key	BSOBHCHTLBDPRN-UHFFFAOYSA-N
Exact Mass	659.005 g/mol

Data and Resources

• 13C nuclear magnetic resonance spectroscopy (13C NMR)HTML
  Go to source

• 13c-nuclear-magneti...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/BSOBHCHTLBDPRN-UHFFFAOYSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/BSOBHCHTLBDPRN-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	Date : 2025-11-25 Start time : 06:29:14 UTC Creator : Sylvia Vanderheiden-Schroen Label : ComP-24438 ID : 355573 Solvent : None Temperature : 297.998060883245 K K Puls programme : zgpg30 Number of scans : 1024 Instrument : Avance NEO 400 Name : TopSpin

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