Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Information
| InChI | InChI=1S/C15H13NO/c1-3-7-14-12(5-1)13-6-2-4-8-15(13)16(14)9-11-10-17-11/h1-8,11H,9-10H2 |
|---|---|
| SMILES | c1ccc2c(c1)n(CC1CO1)c1c2cccc1 |
| InChI Key | VAJIZAPXBKMPRO-UHFFFAOYSA-N |
| Molecular Formula | C15H13NO |
| Exact Mass | 223.270 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/VAJIZAPXBKMPRO-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/VAJIZAPXBKMPRO-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5 |
| Version | |
| Author | Simone Gräßle |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2014-05-27 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 29558033 | surechembl |
| 409180 | surechembl |
| 2775507 | pubchem |
| Molport-000-563-823 | molport |
| The data in this table is sourced from UniChem at EBI. | |