Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C15H14F3N3/c1-2-3-6-10-9-19-14-13(15(16,17)18)20-11-7-4-5-8-12(11)21(10)14/h4-5,7-9H,2-3,6H2,1H3
SMILES	CCCCc1cnc2n1c1ccccc1nc2C(F)(F)F
InChI Key	YXIJMMYJFBYEEB-UHFFFAOYSA-N
Molecular Formula	C15H14F3N3
Exact Mass	293.287 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/YXIJMMYJFBYEEB-UHFFFAOYSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/YXIJMMYJFBYEEB-UHFFFAOYSA-N/CHMO0000593
Version
Author	Chloé Liagre
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T06:03:16.887349
MetadataModified	2024-09-07T21:43:02.450836
MetadataPublished	2022-02-11

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

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