Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR)
Chemical Information
| InChI | InChI=1S/C20H15ClN4/c21-19-20(25-22)24-18-12-16(14-9-5-2-6-10-14)15(11-17(18)23-19)13-7-3-1-4-8-13/h1-12H,22H2,(H,24,25) |
|---|---|
| SMILES | NNc1nc2cc(c3ccccc3)c(cc2nc1Cl)c1ccccc1 |
| InChI Key | YQVKUCOKLYVZCF-UHFFFAOYSA-N |
| Exact Mass | 346.813 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/YQVKUCOKLYVZCF-UHFFFAOYSA-N/CHMO0000593 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/YQVKUCOKLYVZCF-UHFFFAOYSA-N/CHMO0000593 |
| Version | |
| Author | Laura Holzhauer |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2025-03-16 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | 1H nuclear magnetic resonance spectroscopy |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| No additional information available for this Dataset. | |