Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR) ()
Chemical Info
InChI | InChI=1S/C20H16N6/c1-15-7-9-16(10-8-15)12-25-13-18(11-21)20(23-25)26-14-19(22-24-26)17-5-3-2-4-6-17/h2-10,13-14H,12H2,1H3 |
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SMILES | Cc1ccc(Cn2cc(C#N)c(-n3cc(-c4ccccc4)nn3)n2)cc1 |
InChI Key | ZHUFVXOCSYMTKK-UHFFFAOYSA-N |
Molecular Formula | C20H16N6 |
Data and Resources
Related Resources
This dataset related as IsPartOf to https://dx.doi.org/10.14272/ZHUFVXOCSYMTKK-UHFFFAOYSA-N.1
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-sa/4.0 |
Source | |
Version | |
Author | Gräßle, Simone, Wippert, Nicolai |
Maintainer | chemotion-repository |
Language | en |
MetadataCreated | 2024-02-18T03:15:59.713585 |
MetadataModified | 2024-02-18T03:15:59.713590 |
MetadataPublished |
Field | Value |
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Measurement Technique | |
Measurement Variables |