| SpectraBase Compound ID | BOZAJDdK1ZF |
|---|---|
| InChI | InChI=1S/C16H20O/c1-13(2)8-7-9-14(3)12-16(17)15-10-5-4-6-11-15/h4-6,8-11H,7,12H2,1-3H3/b14-9+ |
| InChIKey | ZXOYIUYDOZLJSP-NTEUORMPSA-N |
| Mol Weight | 228.33 g/mol |
| Molecular Formula | C16H20O |
| Exact Mass | 228.151415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D9iaEXJ3EKE |
|---|---|
| Name | 3,7-Dimethyl-3,6-octadienophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.151415263 u |
| Formula | C16H20O |
| InChI | InChI=1S/C16H20O/c1-13(2)8-7-9-14(3)12-16(17)15-10-5-4-6-11-15/h4-6,8-11H,7,12H2,1-3H3/b14-9+ |
| InChIKey | ZXOYIUYDOZLJSP-NTEUORMPSA-N |
| Molecular Weight | 228.335 g/mol |
| SMILES | C(C\C(=C\CC=C(C)C)C)(=O)C=1C=CC=CC1 |