Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C12H11N3O/c1-2-10(16-5-1)7-13-9-3-4-11-12(6-9)15-8-14-11/h1-6,8,13H,7H2,(H,14,15) |
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SMILES | c1coc(c1)CNc1ccc2c(c1)[nH]cn2 |
InChI Key | HIUMIDUFEJBHNY-UHFFFAOYSA-N |
Molecular Formula | C12H11N3O |
Exact Mass | 213.235 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/HIUMIDUFEJBHNY-UHFFFAOYSA-N/CHMO0000595 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/HIUMIDUFEJBHNY-UHFFFAOYSA-N/CHMO0000595 |
Version | |
Author | Niklas Krappel |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T01:23:49.306352 |
MetadataModified | 2024-09-08T01:23:49.306357 |
MetadataPublished | 2023-07-31 |
Field | Value |
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Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |