Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

InChI	InChI=1S/C34H37BF2N2O2S2/c1-6-7-20-42-43-23-32-33-24(2)21-28(14-8-26-10-16-30(40-4)17-11-26)38(33)35(36,37)39-29(22-25(3)34(32)39)15-9-27-12-18-31(41-5)19-13-27/h8-19,21-22H,6-7,20,23H2,1-5H3/b14-8+,15-9+
SMILES	CCCCSSCC1=C2C(=CC(=[N+]2[B-](n2c1c(C)cc2/C=C/c1ccc(cc1)OC)(F)F)/C=C/c1ccc(cc1)OC)C
InChI Key	WRVIWZNJLAZAIL-VOMDNODZSA-N
Exact Mass	618.608 g/mol

Data and Resources

• 13C nuclear magnetic resonance spectroscopy (13C NMR)HTML
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• chmo0000595

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/WRVIWZNJLAZAIL-VOMDNODZSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/WRVIWZNJLAZAIL-VOMDNODZSA-N/CHMO0000595
Version
Author	Lucie Wohlrábová
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-10-27
Related Molecule

Field	Value
Measurement Technique	CHMO:0000595
Measurement Variables

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