650
Summary
| Name: | Beta-Myrcene |
| Formula: | C10 H18 |
| Formal charge: | 0 |
| Formula weight: | 138.25 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (6E)-2,6-dimethylocta-2,6-diene |
| OpenEye OEToolkits | 2.0.4 | (6~{E})-2,6-dimethylocta-2,6-diene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(=[C@H]CCC(=[C@H]C)C)(C)C |
| InChI | InChI | 1.03 | InChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h5,7H,6,8H2,1-4H3/b10-5+ |
| InChIKey | InChI | 1.03 | MZPDTOMKQCMETI-BJMVGYQFSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C/C=C(C)/CCC=C(C)C |
| SMILES | CACTVS | 3.385 | CC=C(C)CCC=C(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C/C=C(\C)/CCC=C(C)C |
| SMILES | OpenEye OEToolkits | 2.0.4 | CC=C(C)CCC=C(C)C |
