| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:11:49 UTC |
|---|
| Update Date | 2025-03-21 18:32:20 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00090331 |
|---|
| Frequency | 31.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C14H20FN |
|---|
| Molecular Mass | 221.158 |
|---|
| SMILES | NCCCC1(c2ccc(F)cc2)CCCC1 |
|---|
| InChI Key | VMHWJIRTRAFUSH-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | phenylbutylamines |
|---|
| Direct Parent | phenylbutylamines |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | aryl fluoridesfluorobenzeneshydrocarbon derivativesmonoalkylaminesorganofluoridesorganonitrogen compoundsorganopnictogen compounds |
|---|
| Substituents | aryl fluorideorganofluorideorganohalogen compoundaryl halidearomatic homomonocyclic compoundfluorobenzenephenylbutylamineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundhalobenzene |
|---|
