Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR) ()
Chemical Info
InChI | InChI=1S/C15H13ClN6O4/c1-9-5-15(20-7-11(17-19-20)8-26-10(2)23)18-21(9)14-4-3-12(22(24)25)6-13(14)16/h3-7H,8H2,1-2H3 |
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SMILES | CC(=O)OCc1cn(-c2cc(C)n(-c3ccc([N+](=O)[O-])cc3Cl)n2)nn1 |
InChI Key | QIRBWRVTFHDFHS-UHFFFAOYSA-N |
Molecular Formula | C15H13ClN6O4 |
Data and Resources
Related Resources
This dataset related as IsPartOf to https://dx.doi.org/10.14272/QIRBWRVTFHDFHS-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 | 2024-02-18T03:59:38.586291 |
MetadataModified | 2024-02-18T03:59:38.586296 |
MetadataPublished |
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Measurement Technique | |
Measurement Variables |