Dataset
![molecular Image]()
o-Dianisidine
Chemical Info
| InChI | InChI=1S/C14H16N2O2/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2/h3-8H,15-16H2,1-2H3 |
|---|---|
| SMILES | COc1cc(ccc1N)-c1ccc(N)c(OC)c1 |
| InChI Key | JRBJSXQPQWSCCF-UHFFFAOYSA-N |
| Molecular Formula | C14H16N2O2 |
| Exact Mass | 244.121 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF414004 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:01:44.968227 |
| MetadataModified | 2025-02-09T19:50:35.568551 |
| MetadataPublished | 2017-01-05 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 82321 | ChEBI |
| DTXSID3025091 | EPA CompTox Dashboard |
| ZINC000000056395 | ZINC |
| J3.253K | Nikkaji |
| HMDB0246003 | Human Metabolome Database |
| KUPZUT | CCDC |
| 1648 | Brenda |
| CB7385595 | ChemicalBook |
| CHEMBL398363 | ChEMBL |
| C19231 | KEGG Ligand |
| MCULE-8032004109 | Mcule |
| 20040442 | NMRShiftDB |
| 3545 | Brenda |
| 109539 | Brenda |
| 93162 | Brenda |
| 498550 | eMolecules |
| MJY508JZXV | FDA SRS |
| SCHEMBL48945 | SureChEMBL |
| 119-90-4 | ACToR |
| PD045033 | ProbesDrugs |
| DDJ | PDBe |
| 8411 | PubChem |
| 15019916 | PubChem: Thomson Pharma |
| The data in this table is sourced from UniChem at EBI. | |