| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:34:29 UTC |
|---|
| Update Date | 2025-03-21 17:56:37 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00002597 |
|---|
| Frequency | 2325.2 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H12 |
|---|
| Molecular Mass | 84.0939 |
|---|
| SMILES | CC=CC(C)C |
|---|
| InChI Key | LGAQJENWWYGFSN-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | hydrocarbons |
|---|
| Class | unsaturated hydrocarbons |
|---|
| Subclass | olefins |
|---|
| Direct Parent | alkenes |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | unsaturated aliphatic hydrocarbons |
|---|
| Substituents | aliphatic acyclic compoundalkeneunsaturated aliphatic hydrocarbon |
|---|
