| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:41:20 UTC |
|---|
| Update Date | 2025-03-21 17:59:01 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00018275 |
|---|
| Frequency | 227.1 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H12 |
|---|
| Molecular Mass | 108.0939 |
|---|
| SMILES | CC1(C)C=CC=CC1 |
|---|
| InChI Key | KGYVJUSBRARRBU-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | hydrocarbons |
|---|
| Class | unsaturated hydrocarbons |
|---|
| Subclass | olefins |
|---|
| Direct Parent | cyclic olefins |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | unsaturated aliphatic hydrocarbons |
|---|
| Substituents | cyclic olefinaliphatic homomonocyclic compoundunsaturated aliphatic hydrocarbon |
|---|
