Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

Chemical Info

InChI	InChI=1S/C14H11FN2/c1-10-5-4-8-17-9-13(16-14(10)17)11-6-2-3-7-12(11)15/h2-9H,1H3
SMILES	Fc1ccccc1c1cn2c(n1)c(C)ccc2
InChI Key	HFJDLAHRMQHDEB-UHFFFAOYSA-N
Molecular Formula	C14H11FN2
Exact Mass	226.249 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/HFJDLAHRMQHDEB-UHFFFAOYSA-N/CHMO0000597
License URL
Source	https://www.chemotion-repository.net/inchikey/HFJDLAHRMQHDEB-UHFFFAOYSA-N/CHMO0000597
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T00:42:54.715245
MetadataModified	2024-09-08T00:42:54.715250
MetadataPublished	2023-03-03

Field	Value
Measurement Technique	19F nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
71628504	PubChem
ZINC000095082350	ZINC
The data in this table is sourced from UniChem at EBI.