| SpectraBase Compound ID | 4CKxZHJwRbF |
|---|---|
| InChI | InChI=1S/C14H18O/c1-14(2,3)13(15)11-7-10-12-8-5-4-6-9-12/h4-10H,11H2,1-3H3/b10-7+ |
| InChIKey | LEAJXRODHPKUDG-JXMROGBWSA-N |
| Mol Weight | 202.3 g/mol |
| Molecular Formula | C14H18O |
| Exact Mass | 202.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JRHuoNmAqFA |
|---|---|
| Name | (5E)-2,2-Dimethyl-6-phenyl-5-hexen-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.135765199 u |
| Formula | C14H18O |
| InChI | InChI=1S/C14H18O/c1-14(2,3)13(15)11-7-10-12-8-5-4-6-9-12/h4-10H,11H2,1-3H3/b10-7+ |
| InChIKey | LEAJXRODHPKUDG-JXMROGBWSA-N |
| Molecular Weight | 202.297 g/mol |
| SMILES | C(C(C)(C)C)(=O)C\C=C\C1=CC=CC=C1 |