V9L
Summary
| Name: | ortho-vanillin |
| Synonyms: | 3-methoxy-2-oxidanyl-benzaldehyde 2-hydroxy-3-methoxybenzaldehyde |
| Formula: | C8 H8 O3 |
| Formal charge: | 0 |
| Formula weight: | 152.147 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-methoxy-2-oxidanyl-benzaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-9)8(7)10/h2-5,10H,1H3 |
| InChIKey | InChI | 1.06 | JJVNINGBHGBWJH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(C=O)c1O |
| SMILES | CACTVS | 3.385 | COc1cccc(C=O)c1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1cccc(c1O)C=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1cccc(c1O)C=O |
