KJ6
Summary
| Name: | 6-methyl-4-oxidanyl-pyran-2-one |
| Formula: | C6 H6 O3 |
| Formal charge: | 0 |
| Formula weight: | 126.11 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-methyl-4-oxidanyl-pyran-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C6H6O3/c1-4-2-5(7)3-6(8)9-4/h2-3,7H,1H3 |
| InChIKey | InChI | 1.06 | NSYSSMYQPLSPOD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1=CC(=CC(=O)O1)O |
| SMILES | CACTVS | 3.385 | CC1=CC(=CC(=O)O1)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC1=CC(=CC(=O)O1)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1=CC(=CC(=O)O1)O |
