LSR
Summary
| Name: | 1,3,3-trimethyl-2-[(1E,3E)-3-methylpenta-1,3-dien-1-yl]cyclohexene |
| Formula: | C15 H24 |
| Formal charge: | 0 |
| Formula weight: | 204.351 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1,3,3-trimethyl-2-[(1E,3E)-3-methylpenta-1,3-dien-1-yl]cyclohexene |
| OpenEye OEToolkits | 1.5.0 | 1,3,3-trimethyl-2-[(1E,3E)-3-methylpenta-1,3-dienyl]cyclohexene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | C(/C1=C(CCCC1(C)C)C)=C\C(=C\C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C\C=C(C)\C=C\C1=C(C)CCCC1(C)C |
| SMILES | CACTVS | 3.341 | CC=C(C)C=CC1=C(C)CCCC1(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C\C=C(/C)\C=C\C1=C(CCCC1(C)C)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC=C(C)C=CC1=C(CCCC1(C)C)C |
| InChI | InChI | 1.03 | InChI=1S/C15H24/c1-6-12(2)9-10-14-13(3)8-7-11-15(14,4)5/h6,9-10H,7-8,11H2,1-5H3/b10-9+,12-6+ |
| InChIKey | InChI | 1.03 | KUEVAPFABUUVHS-AYCKBHPDSA-N |
