Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR) ()

Chemical Info

InChI	InChI=1S/C12H11N5O/c1-18-10-4-2-9(3-5-10)11-8-17(16-14-11)12-6-7-13-15-12/h2-8H,1H3,(H,13,15)
SMILES	COc1ccc(-c2cn(-c3cc[nH]n3)nn2)cc1
InChI Key	PQOYNAQPLQYWLU-UHFFFAOYSA-N
Molecular Formula	C12H11N5O

Data and Resources

• 1H nuclear magnetic resonance spectroscopy (1H NMR) ()HTML
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• 1h-nmr
• chemistry

Related Resources

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

Metadata Information

• Additional
• Measurement

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-sa/4.0
Source
Version
Author	Gräßle, Simone, Wippert, Nicolai
Maintainer	chemotion-repository
Language	en
MetadataCreated	2024-02-18T03:26:41.699122
MetadataModified	2024-02-18T03:26:41.699127
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables