Dataset
![molecular Image]()
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
| InChI | InChI=1S/C9H10O/c1-7-3-4-9(6-10)5-8(7)2/h3-6H,1-2H3 |
|---|---|
| SMILES | O=Cc1ccc(c(c1)C)C |
| InChI Key | POQJHLBMLVTHAU-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
| Exact Mass | 134.175 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/POQJHLBMLVTHAU-UHFFFAOYSA-N/CHMO0000596 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/POQJHLBMLVTHAU-UHFFFAOYSA-N/CHMO0000596 |
| Version | |
| Author | Sylvia Vanderheiden-Schroen |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2024-09-08T03:55:50.716432 |
| MetadataModified | 2024-09-08T03:55:50.716437 |
| MetadataPublished | 2024-06-24 |
| Field | Value |
|---|---|
| Measurement Technique | distortionless enhancement with polarization transfer |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 22278 | PubChem |
| J42.310F | Nikkaji |
| 20208748 | NMRShiftDB |
| SCHEMBL98097 | SureChEMBL |
| CHEMBL3187739 | ChEMBL |
| MCULE-4139700449 | Mcule |
| 167406 | ChEBI |
| 14747705 | PubChem: Thomson Pharma |
| 5973-71-7 | ACToR |
| 16G1J12ARB | FDA SRS |
| 514784 | eMolecules |
| 43247 | Brenda |
| ZINC000002146875 | ZINC |
| DTXSID2041626 | EPA CompTox Dashboard |
| The data in this table is sourced from UniChem at EBI. | |