| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:20:26 UTC |
|---|
| Update Date | 2025-03-21 18:36:35 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00111396 |
|---|
| Frequency | 23.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C11H14BrN |
|---|
| Molecular Mass | 239.031 |
|---|
| SMILES | CN1CCCC1c1ccc(Br)cc1 |
|---|
| InChI Key | RIEICTJOEICJJT-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrrolidines |
|---|
| Subclass | phenylpyrrolidines |
|---|
| Direct Parent | phenylpyrrolidines |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | aralkylaminesaryl bromidesazacyclic compoundsbromobenzeneshydrocarbon derivativesn-alkylpyrrolidinesorganobromidesorganopnictogen compoundspyrrolestrialkylamines |
|---|
| Substituents | monocyclic benzene moietyaromatic heteromonocyclic compoundazacyclen-alkylpyrrolidine2-phenylpyrrolidinetertiary aliphatic aminebromobenzeneorganohalogen compoundaralkylaminearyl halidepyrroleorganonitrogen compoundorganobromideorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzenearyl bromideaminetertiary amine |
|---|
