Dataset
![molecular Image]()
Benzamide
Chemical Info
| InChI | InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9) |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)N |
| InChI Key | KXDAEFPNCMNJSK-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |
| Exact Mass | 121.053 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-sa/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01074402 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2025-02-09T09:32:27.224837 |
| MetadataModified | 2025-02-09T09:32:27.414043 |
| MetadataPublished | 2024-06-14 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 50106187 | BindingDB |
| HY-Z0283 | MedChemExpress |
| BZAMID | CCDC |
| DTXSID0021709 | EPA CompTox Dashboard |
| ZINC000000152996 | ZINC |
| J1.374I | Nikkaji |
| UNU | PDBe |
| C09815 | KEGG Ligand |
| CHEMBL267373 | ChEMBL |
| 28179 | ChEBI |
| MCULE-2811211507 | Mcule |
| SCHEMBL16352 | SureChEMBL |
| 10008844 | NMRShiftDB |
| 97448 | Brenda |
| 105483 | Brenda |
| 1408 | Brenda |
| HMDB0004461 | Human Metabolome Database |
| CB6853808 | ChemicalBook |
| 479292 | eMolecules |
| 27677655 | eMolecules |
| 2331 | PubChem |
| PD015403 | ProbesDrugs |
| 221833 | Brenda |
| 15242870 | PubChem: Thomson Pharma |
| 55-21-0 | ACToR |
| 27208-38-4 | ACToR |
| 6X80438640 | FDA SRS |
| The data in this table is sourced from UniChem at EBI. | |