Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C12H12N2/c1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12/h3-8H,1-2H3 |
---|---|
SMILES | Cc1cccc(n1)c1cccc(n1)C |
InChI Key | OHJPGUSXUGHOGE-UHFFFAOYSA-N |
Molecular Formula | C12H12N2 |
Exact Mass | 184.237 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/OHJPGUSXUGHOGE-UHFFFAOYSA-N/CHMO0000596.1 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/OHJPGUSXUGHOGE-UHFFFAOYSA-N/CHMO0000596.1 |
Version | |
Author | Simone Gräßle |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2025-01-29T10:41:14.139795 |
MetadataModified | 2025-01-29T16:33:38.986438 |
MetadataPublished | 2024-11-21 |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
MCULE-5271745802 | Mcule |
SCHEMBL196966 | SureChEMBL |
10019268 | NMRShiftDB |
20445 | PubChem |
NOFZUD | CCDC |
J23.946A | Nikkaji |
50401355 | BindingDB |
DTXSID30196041 | EPA CompTox Dashboard |
ZINC000000403297 | ZINC |
CHEMBL2205806 | ChEMBL |
515032 | eMolecules |
16202673 | PubChem: Thomson Pharma |
4411-80-7 | ACToR |
CB4275688 | ChemicalBook |
AF3HZ0ZAN4 | FDA SRS |
The data in this table is sourced from UniChem at EBI. |