80N
Summary
| Name: | (1R,2E,6E,9E)-2,5,5,9-tetramethylcycloundeca-2,6,9-trien-1-ol |
| Formula: | C15 H24 O |
| Formal charge: | 0 |
| Formula weight: | 220.35 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (1~{R},2~{E},6~{E},9~{E})-2,5,5,9-tetramethylcycloundeca-2,6,9-trien-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H24O/c1-12-6-5-10-15(3,4)11-9-13(2)14(16)8-7-12/h5,7,9-10,14,16H,6,8,11H2,1-4H3/b10-5+,12-7+,13-9+/t14-/m1/s1 |
| InChIKey | InChI | 1.03 | BKFWFEFTVNGGAQ-YKRGQYNGSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C\C1=C/C[C@@H](O)\C(=C\CC(C)(C)/C=C/C1)C |
| SMILES | CACTVS | 3.385 | CC1=CC[CH](O)C(=CCC(C)(C)C=CC1)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C/C/1=C\C[C@H](/C(=C/CC(/C=C/C1)(C)C)/C)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1=CCC(C(=CCC(C=CC1)(C)C)C)O |
