Dataset
![molecular Image]()
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
| InChI | InChI=1S/C9H7NO/c11-6-8-5-7-3-1-2-4-9(7)10-8/h1-6,10H |
|---|---|
| SMILES | O=Cc1cc2c([nH]1)cccc2 |
| InChI Key | SBNOTUDDIXOFSN-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO |
| Exact Mass | 145.158 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/SBNOTUDDIXOFSN-UHFFFAOYSA-N/CHMO0000596.1 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/SBNOTUDDIXOFSN-UHFFFAOYSA-N/CHMO0000596.1 |
| Version | |
| Author | Jana Alpin |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-02-04T13:26:13.403074 |
| MetadataModified | 2025-02-04T13:26:13.403079 |
| MetadataPublished | 2025-01-08 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | distortionless enhancement with polarization transfer |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DTXSID50172468 | EPA CompTox Dashboard |
| 251804 | Brenda |
| J1.035.660A | Nikkaji |
| 50037781 | BindingDB |
| R5N9CD7DLM | FDA SRS |
| CHEMBL223708 | ChEMBL |
| 96389 | PubChem |
| 9FF | PDBe |
| 15120099 | PubChem: Thomson Pharma |
| SCHEMBL98455 | SureChEMBL |
| 19005-93-7 | ACToR |
| 985174 | eMolecules |
| CB4841584 | ChemicalBook |
| ZINC000004100123 | ZINC |
| MCULE-6191488524 | Mcule |
| The data in this table is sourced from UniChem at EBI. | |