Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C13H15N3O2/c1-3-12(17)15-10-6-5-9-8-14-16(11(9)7-10)13(18)4-2/h5-8H,3-4H2,1-2H3,(H,15,17) |
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SMILES | CCC(=O)Nc1ccc2c(c1)n(nc2)C(=O)CC |
InChI Key | XYXZVYXWLDBRLV-UHFFFAOYSA-N |
Molecular Formula | C13H15N3O2 |
Exact Mass | 245.277 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/XYXZVYXWLDBRLV-UHFFFAOYSA-N/CHMO0000595 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/XYXZVYXWLDBRLV-UHFFFAOYSA-N/CHMO0000595 |
Version | |
Author | Niklas Krappel |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T01:17:04.499927 |
MetadataModified | 2024-09-08T01:17:04.499933 |
MetadataPublished | 2023-07-31 |
Field | Value |
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Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |