KSW
Summary
| Name: | 2-methylcyclopenta-2,4-dien-1-one |
| Formula: | C6 H6 O |
| Formal charge: | 0 |
| Formula weight: | 94.111 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-methylcyclopenta-2,4-dien-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H6O/c1-5-3-2-4-6(5)7/h2-4H,1H3 |
| InChIKey | InChI | 1.03 | LYYZLRGLZHSYLN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1=CC=CC1=O |
| SMILES | CACTVS | 3.385 | CC1=CC=CC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC1=CC=CC1=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1=CC=CC1=O |
