Dataset
![molecular Image]()
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
| InChI | InChI=1S/C13H13N/c14-10-11-5-4-8-13(9-11)12-6-2-1-3-7-12/h1-9H,10,14H2 |
|---|---|
| SMILES | NCc1cccc(c1)c1ccccc1 |
| InChI Key | WKHABRRJMGVELW-UHFFFAOYSA-N |
| Molecular Formula | C13H13N |
| Exact Mass | 183.249 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/WKHABRRJMGVELW-UHFFFAOYSA-N/CHMO0000596 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/WKHABRRJMGVELW-UHFFFAOYSA-N/CHMO0000596 |
| Version | |
| Author | Jana Alpin |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2024-09-08T03:26:19.679714 |
| MetadataModified | 2024-09-08T03:26:19.679720 |
| MetadataPublished | 2024-05-15 |
| Field | Value |
|---|---|
| Measurement Technique | distortionless enhancement with polarization transfer |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 2760368 | PubChem |
| CHEMBL4162063 | ChEMBL |
| 50331395 | BindingDB |
| CB1191626 | ChemicalBook |
| J2.283.183F | Nikkaji |
| 1976128 | eMolecules |
| 177976-49-7 | ACToR |
| SCHEMBL43554 | SureChEMBL |
| MCULE-8782625424 | Mcule |
| ZINC000002562430 | ZINC |
| DTXSID70375136 | EPA CompTox Dashboard |
| The data in this table is sourced from UniChem at EBI. | |