64Z
Summary
Name: | Geraniol |
Formula: | C10 H18 O |
Formal charge: | 0 |
Formula weight: | 154.249 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (2E)-3,7-dimethylocta-2,6-dien-1-ol |
OpenEye OEToolkits | 2.0.4 | (2~{E})-3,7-dimethylocta-2,6-dien-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C(=C/CC\C(=C\CO)C)(\C)C |
InChI | InChI | 1.03 | InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+ |
InChIKey | InChI | 1.03 | GLZPCOQZEFWAFX-JXMROGBWSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(C)=CCC\C(C)=C\CO |
SMILES | CACTVS | 3.385 | CC(C)=CCCC(C)=CCO |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | CC(=CCC/C(=C/CO)/C)C |
SMILES | OpenEye OEToolkits | 2.0.4 | CC(=CCCC(=CCO)C)C |