Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Information
| InChI | InChI=1S/C12H7Cl2N/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6,15H |
|---|---|
| SMILES | Clc1ccc2c(c1)c1cc(Cl)ccc1[nH]2 |
| InChI Key | BIMDTNQPZWJKPL-UHFFFAOYSA-N |
| Molecular Formula | C12H7Cl2N |
| Exact Mass | 236.097 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/BIMDTNQPZWJKPL-UHFFFAOYSA-N/CHMO0000596 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/BIMDTNQPZWJKPL-UHFFFAOYSA-N/CHMO0000596 |
| Version | |
| Author | Victor Larignon |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2021-12-25 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | distortionless enhancement with polarization transfer |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| BABCIU | CCDC |
| DTXSID40284786 | EPA CompTox Dashboard |
| CB8465782 | ChemicalBook |
| J81.060F | Nikkaji |
| ZINC000000134267 | ZINC |
| 236487 | PubChem |
| SCHEMBL607827 | SureChEMBL |
| CHEMBL5090876 | ChEMBL |
| 5599-71-3 | ACToR |
| 918729 | eMolecules |
| MCULE-9588565169 | Mcule |
| The data in this table is sourced from UniChem at EBI. | |