Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR)
Chemical Information
| InChI | InChI=1S/C22H14N4/c1-2-8-15(9-3-1)21-22(26-19-13-7-6-12-18(19)25-21)20-14-23-16-10-4-5-11-17(16)24-20/h1-14H |
|---|---|
| SMILES | c1ccc(cc1)c1nc2ccccc2nc1c1cnc2c(n1)cccc2 |
| InChI Key | ORXUYYBDRVICKY-UHFFFAOYSA-N |
| Molecular Formula | C22H14N4 |
| Exact Mass | 334.373 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/ORXUYYBDRVICKY-UHFFFAOYSA-N/CHMO0000593 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/ORXUYYBDRVICKY-UHFFFAOYSA-N/CHMO0000593 |
| Version | |
| Author | Jérôme Klein |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2021-08-07 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | 1H nuclear magnetic resonance spectroscopy |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 95366780 | pubchem |
| The data in this table is sourced from UniChem at EBI. | |