Dataset
Fourier transform infrared spectroscopy (FTIR)
Chemical Info
InChI | InChI=1S/C11H12N6O2/c1-19-9-4-2-8(3-5-9)7-12-15-11(18)6-10-13-16-17-14-10/h2-5,7H,6H2,1H3,(H,15,18)(H,13,14,16,17)/b12-7+ |
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SMILES | COc1ccc(cc1)/C=N/NC(=O)Cc1nnn[nH]1 |
InChI Key | MZMWXNCBDICVDV-KPKJPENVSA-N |
Molecular Formula | C11H12N6O2 |
Exact Mass | 260.252 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/MZMWXNCBDICVDV-KPKJPENVSA-N/CHMO0000636 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/MZMWXNCBDICVDV-KPKJPENVSA-N/CHMO0000636 |
Version | |
Author | Andreas Link |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T00:59:36.763756 |
MetadataModified | 2024-09-08T00:59:36.763760 |
MetadataPublished | 2023-05-22 |
Field | Value |
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Measurement Technique | Fourier transform infrared spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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ZINC000006736415 | ZINC |
168059111 | PubChem |
The data in this table is sourced from UniChem at EBI. |