![6-(2',6'-Dimethylbicyclo[3.1.1]hept-2'-en-6'-yl)hex-3-en-2-one](/api/spectrum/18AsogQLxOR/structure.png?h=300&w=458 "6-(2',6'-Dimethylbicyclo[3.1.1]hept-2'-en-6'-yl)hex-3-en-2-one")
| SpectraBase Compound ID | 2udHskzG18n |
|---|---|
| InChI | InChI=1S/C15H22O/c1-11-7-8-13-10-14(11)15(13,3)9-5-4-6-12(2)16/h4,6-7,13-14H,5,8-10H2,1-3H3/b6-4+ |
| InChIKey | GIZYNRLTFAXPFG-GQCTYLIASA-N |
| Mol Weight | 218.34 g/mol |
| Molecular Formula | C15H22O |
| Exact Mass | 218.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 18AsogQLxOR |
|---|---|
| Name | 6-(2',6'-Dimethylbicyclo[3.1.1]hept-2'-en-6'-yl)hex-3-en-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.167065327 u |
| Formula | C15H22O |
| InChI | InChI=1S/C15H22O/c1-11-7-8-13-10-14(11)15(13,3)9-5-4-6-12(2)16/h4,6-7,13-14H,5,8-10H2,1-3H3/b6-4+ |
| InChIKey | GIZYNRLTFAXPFG-GQCTYLIASA-N |
| Molecular Weight | 218.340 g/mol |
| SMILES | C12C(CC\C=C\C(=O)C)(C)C(C2)CC=C1C |