| SpectraBase Compound ID | BxoUwokiTux |
|---|---|
| InChI | InChI=1S/C14H22O/c1-10(2)9-12(15)13-11(3)7-6-8-14(13,4)5/h7,9,13H,6,8H2,1-5H3 |
| InChIKey | XICOPUZTBBSGCF-UHFFFAOYSA-N |
| Mol Weight | 206.33 g/mol |
| Molecular Formula | C14H22O |
| Exact Mass | 206.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DaA8MnoW0Am |
|---|---|
| Name | 3-Methyl-1-(2,6,6-trimethyl-1-cyclohex-2-enyl)-2-buten-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.167065327 u |
| Formula | C14H22O |
| InChI | InChI=1S/C14H22O/c1-10(2)9-12(15)13-11(3)7-6-8-14(13,4)5/h7,9,13H,6,8H2,1-5H3 |
| InChIKey | XICOPUZTBBSGCF-UHFFFAOYSA-N |
| Molecular Weight | 206.329 g/mol |
| SMILES | C(C1C(=CCCC1(C)C)C)(C=C(C)C)=O |