Dataset

mass spectrometry (MS) ()

Chemical Info

InChI	InChI=1S/C17H18N6/c1-3-4-5-15-12-22(21-19-15)17-10-13(2)23(20-17)16-8-6-14(11-18)7-9-16/h6-10,12H,3-5H2,1-2H3
SMILES	CCCCc1cn(-c2cc(C)n(-c3ccc(C#N)cc3)n2)nn1
InChI Key	WZTARLNNZGQBDW-UHFFFAOYSA-N
Molecular Formula	C17H18N6

Data and Resources

• mass spectrometry (MS) ()HTML
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• mass-spectrometry

Related Resources

• This dataset related as IsPartOf to https://dx.doi.org/10.14272/WZTARLNNZGQBDW-UHFFFAOYSA-N.1

Metadata Information

• Additional
• Measurement

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by/4.0
Source
Version
Author	Gräßle, Simone, Wippert, Nicolai
Maintainer	chemotion-repository
Language	en
MetadataCreated	2024-02-18T04:05:02.217357
MetadataModified	2024-02-18T04:05:02.217362
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables