Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Information
| InChI | InChI=1S/C8H11O3P/c1-10-12(9,11-2)8-6-4-3-5-7-8/h3-7H,1-2H3 |
|---|---|
| SMILES | COP(=O)(c1ccccc1)OC |
| InChI Key | OXDOANYFRLHSML-UHFFFAOYSA-N |
| Molecular Formula | C8H11O3P |
| Exact Mass | 186.145 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/OXDOANYFRLHSML-UHFFFAOYSA-N/CHMO0000596 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/OXDOANYFRLHSML-UHFFFAOYSA-N/CHMO0000596 |
| Version | |
| Author | Christoph Zippel |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2022-01-10 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | distortionless enhancement with polarization transfer |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| ZINC000001691068 | ZINC |
| J150.754K | Nikkaji |
| DTXSID20176933 | EPA CompTox Dashboard |
| CB3178810 | ChemicalBook |
| 75234 | PubChem |
| 2240-41-7 | ACToR |
| 1641-61-8 | ACToR |
| SCHEMBL499887 | SureChEMBL |
| 16361877 | PubChem: Thomson Pharma |
| 2800343 | eMolecules |
| 20199001 | NMRShiftDB |
| The data in this table is sourced from UniChem at EBI. | |