Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR)
Chemical Information
| InChI | InChI=1S/C15H20N4/c1-11-9-10-12-7-6-8-13(14(12)16-11)17-15(18(2)3)19(4)5/h6-10H,1-5H3 |
|---|---|
| SMILES | Cc1ccc2c(n1)c(ccc2)N=C(N(C)C)N(C)C |
| InChI Key | XNDIRRNFWBFJDQ-UHFFFAOYSA-N |
| Molecular Formula | C15H20N4 |
| Exact Mass | 256.346 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/XNDIRRNFWBFJDQ-UHFFFAOYSA-N/CHMO0000593 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/XNDIRRNFWBFJDQ-UHFFFAOYSA-N/CHMO0000593 |
| Version | |
| Author | Alexander Hoffmann |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2022-03-05 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | 1H nuclear magnetic resonance spectroscopy |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 101584847 | pubchem |
| REJMUS | CCDC |
| The data in this table is sourced from UniChem at EBI. | |