Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Information

InChI	InChI=1S/C18H25BF2N2S2/c1-6-7-8-24-25-11-16-17-12(2)9-14(4)22(17)19(20,21)23-15(5)10-13(3)18(16)23/h9-10H,6-8,11H2,1-5H3
SMILES	CCCCSSCC1=C2C(=CC(=[N+]2[B-](n2c1c(C)cc2C)(F)F)C)C
InChI Key	PZZURDWHXBIETM-UHFFFAOYSA-N
Exact Mass	382.342 g/mol

Data and Resources

• 1H nuclear magnetic resonance spectroscopy (1H NMR)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/PZZURDWHXBIETM-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/PZZURDWHXBIETM-UHFFFAOYSA-N/CHMO0000593
Version
Author	Lucie Wohlrábová
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-12-03
Related Molecule

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables

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