| SpectraBase Compound ID | 8RGCKFBvjmz |
|---|---|
| InChI | InChI=1S/C11H18O/c1-8(2)6-7-11(9(3)4)10(5)12/h6H,7H2,1-5H3 |
| InChIKey | XUOWQIBGRJIEDN-UHFFFAOYSA-N |
| Mol Weight | 166.26 g/mol |
| Molecular Formula | C11H18O |
| Exact Mass | 166.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HM98o3QUPpc |
|---|---|
| Name | 3-Acetyl-2,6-dimethyl-2,5-heptadiene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.135765199 u |
| Formula | C11H18O |
| InChI | InChI=1S/C11H18O/c1-8(2)6-7-11(9(3)4)10(5)12/h6H,7H2,1-5H3 |
| InChIKey | XUOWQIBGRJIEDN-UHFFFAOYSA-N |
| Molecular Weight | 166.264 g/mol |
| SMILES | CC(=C(CC=C(C)C)C(=O)C)C |