Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C17H22F2N4O2/c1-6-25-16(24)17(18,19)14-9-13(10-20)7-8-15(14)21-22-23(11(2)3)12(4)5/h7-9,11-12H,6H2,1-5H3/b22-21+
SMILES	CCOC(=O)C(c1cc(C#N)ccc1/N=N/N(C(C)C)C(C)C)(F)F
InChI Key	QQRDTCPJIQVHIN-QURGRASLSA-N
Molecular Formula	C17H22F2N4O2
Exact Mass	352.379 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/QQRDTCPJIQVHIN-QURGRASLSA-N/NMR/1H/CDCl3/400
License URL
Source	https://www.chemotion-repository.net/inchikey/QQRDTCPJIQVHIN-QURGRASLSA-N/NMR/1H/CDCl3/400
Version
Author	Andreas Hafner
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-06T23:37:34.386456
MetadataModified	2024-09-07T12:52:40.383126
MetadataPublished	2014-05-27

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

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