| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 12:22:55 UTC |
|---|
| Update Date | 2025-03-24 21:36:23 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01831719 |
|---|
| Frequency | 0.7 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H9ClO |
|---|
| Molecular Mass | 144.0342 |
|---|
| SMILES | CC1(C)CC(=O)C=C1Cl |
|---|
| InChI Key | DXRYYIJPUAOXJH-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organohalogen compounds |
|---|
| Class | vinyl halides |
|---|
| Subclass | vinylogous halides |
|---|
| Direct Parent | vinylogous halides |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | chloroalkenescyclic ketoneshydrocarbon derivativesorganic oxidesorganochloridesvinyl chlorides |
|---|
| Substituents | carbonyl groupchloroalkeneorganochloridecyclic ketonevinylogous halideketoneorganic oxideorganic oxygen compoundhaloalkenealiphatic homomonocyclic compoundhydrocarbon derivativevinyl chlorideorganooxygen compound |
|---|
