Dataset

mass spectrometry (MS) ()

Chemical Info

InChI	InChI=1S/C23H20N6O3/c1-3-32-23(30)20-14-28(13-17-6-4-5-16(11-17)12-24)26-22(20)29-15-21(25-27-29)18-7-9-19(31-2)10-8-18/h4-11,14-15H,3,13H2,1-2H3
SMILES	CCOC(=O)c1cn(Cc2cccc(C#N)c2)nc1-n1cc(-c2ccc(OC)cc2)nn1
InChI Key	KJMWCYALHNEPDX-UHFFFAOYSA-N
Molecular Formula	C23H20N6O3

Data and Resources

• mass spectrometry (MS) ()HTML
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Related Resources

• This dataset related as IsPartOf to https://dx.doi.org/10.14272/KJMWCYALHNEPDX-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	2024-02-18T03:48:39.466822
MetadataModified	2024-02-18T03:48:39.466827
MetadataPublished

Field	Value
Measurement Technique
Measurement Variables