Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR) ()
Chemical Info
InChI | InChI=1S/C22H21N4.ClH/c1-26-13-12-20(22(15-26)24-25-23)21-14-18-7-6-16-2-4-17(5-3-16)8-10-19(21)11-9-18;/h2-5,9,11-15H,6-8,10H2,1H3;1H/q+1;/p-1 |
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SMILES | C[n+]1cc(=N[N+]#N)c(-c2cc3ccc2CCc2ccc(cc2)CC3)c[cH-]1.[Cl-] |
InChI Key | YVHVOAZMKUDAFB-UHFFFAOYSA-M |
Molecular Formula | C22H21ClN4 |
Data and Resources
Related Resources
This dataset related as IsPartOf to https://dx.doi.org/10.14272/YVHVOAZMKUDAFB-UHFFFAOYSA-M.1
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by/4.0 |
Source | |
Version | |
Author | QIU, XUJUN, Bräse, Stefan |
Maintainer | chemotion-repository |
Language | en |
MetadataCreated | 2024-02-18T03:05:04.134169 |
MetadataModified | 2024-02-18T03:05:04.134175 |
MetadataPublished |
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Measurement Technique | |
Measurement Variables |