Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR) (bromorhenium;2-(4-butyltriazol-1-yl)-3-phenylquinoxaline;carbon monoxide)
Chemical Info
InChI | InChI=1S/C20H19N5.3CO.BrH.Re/c1-2-3-11-16-14-25(24-23-16)20-19(15-9-5-4-6-10-15)21-17-12-7-8-13-18(17)22-20;3*1-2;;/h4-10,12-14H,2-3,11H2,1H3;;;;1H;/q;;;;;+1/p-1 |
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SMILES | CCCCc1cn(-c2nc3ccccc3nc2-c2ccccc2)nn1.[Br-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Re+] |
InChI Key | BKFBOTQHKAJKOY-UHFFFAOYSA-M |
Molecular Formula | C23H19BrN5O3Re |
Exact Mass | 679.548 g/mol |
Data and Resources
Related Resources
This dataset related as IsPartOf to https://dx.doi.org/10.14272/BKFBOTQHKAJKOY-UHFFFAOYSA-M.1
Metadata Information
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DOI | |
License URL | https://creativecommons.org/licenses/by-sa/4.0 |
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Author | Holzhauer, Laura |
Maintainer | chemotion.net |
Language | en |
MetadataCreated | 2022-10-06T14:39:36.552156 |
MetadataModified | 2022-10-06T14:39:36.552160 |
MetadataPublished |
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