Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Information
| InChI | InChI=1S/C12H11NO/c1-14-11-7-5-10(6-8-11)12-4-2-3-9-13-12/h2-9H,1H3 |
|---|---|
| SMILES | COc1ccc(cc1)c1ccccn1 |
| InChI Key | QUMXRZNAUFKBAS-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO |
| Exact Mass | 185.222 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/QUMXRZNAUFKBAS-UHFFFAOYSA-N/CHMO0000596.1 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/QUMXRZNAUFKBAS-UHFFFAOYSA-N/CHMO0000596.1 |
| Version | |
| Author | Simone Gräßle |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2024-01-19 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | distortionless enhancement with polarization transfer |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEMBL2220852 | chembl |
| 29496947 | surechembl |
| 913393 | surechembl |
| 220239 | pubchem |
| Molport-000-004-947 | molport |
| The data in this table is sourced from UniChem at EBI. | |