Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C17H22N6/c1-12(2)22(13(3)4)21-19-17-10-14(5)20-23(17)16-8-6-15(11-18)7-9-16/h6-10,12-13H,1-5H3/b21-19+
SMILES	N#Cc1ccc(cc1)n1nc(cc1/N=N/N(C(C)C)C(C)C)C
InChI Key	WPXPVVIOPAJXSL-XUTLUUPISA-N
Molecular Formula	C17H22N6
Exact Mass	310.397 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/WPXPVVIOPAJXSL-XUTLUUPISA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/WPXPVVIOPAJXSL-XUTLUUPISA-N/CHMO0000593
Version
Author	Nicolai Wippert
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T02:21:23.698725
MetadataModified	2024-09-08T02:21:23.698731
MetadataPublished	2024-02-14

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

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