Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

Chemical Info

InChI	InChI=1S/C9H4BrF3N2/c10-8-7(9(11,12)13)14-5-3-1-2-4-6(5)15-8/h1-4H
SMILES	Brc1nc2ccccc2nc1C(F)(F)F
InChI Key	AMNWOCHDJMGDRU-UHFFFAOYSA-N
Molecular Formula	C9H4BrF3N2
Exact Mass	277.041 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/AMNWOCHDJMGDRU-UHFFFAOYSA-N/CHMO0000597
License URL
Source	https://www.chemotion-repository.net/inchikey/AMNWOCHDJMGDRU-UHFFFAOYSA-N/CHMO0000597
Version
Author	Victor Larignon
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T01:49:24.162519
MetadataModified	2024-09-08T01:49:24.162525
MetadataPublished	2023-11-03

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

Data-Source Molecule ID	Data-Source
82378774	PubChem
The data in this table is sourced from UniChem at EBI.