| SpectraBase Compound ID | ATYxYKselAx |
|---|---|
| InChI | InChI=1S/C20H28O2/c1-8-9-10-11-17(21)14-12-15(19(2,3)4)18(22)16(13-14)20(5,6)7/h1,12-13,22H,9-11H2,2-7H3 |
| InChIKey | ZHXUEUKVDMWSKV-UHFFFAOYSA-N |
| Mol Weight | 300.44 g/mol |
| Molecular Formula | C20H28O2 |
| Exact Mass | 300.20893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9MeHcgz3pi7 |
|---|---|
| Name | Tebufelone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.208930140 u |
| Formula | C20H28O2 |
| InChI | InChI=1S/C20H28O2/c1-8-9-10-11-17(21)14-12-15(19(2,3)4)18(22)16(13-14)20(5,6)7/h1,12-13,22H,9-11H2,2-7H3 |
| InChIKey | ZHXUEUKVDMWSKV-UHFFFAOYSA-N |
| SMILES | CC(C)(C)C=1C=C(C=C(C1O)C(C)(C)C)C(CCCC#C)=O |