| SpectraBase Compound ID | 2BI3VNmf1jl |
|---|---|
| InChI | InChI=1S/C20H24O2/c1-8-17(22-18(21)20(5,6)7)16-12-10-9-11-15(16)13-14-19(2,3)4/h1,9-12,17H,2-7H3 |
| InChIKey | HMEHNWJIFLPVGL-UHFFFAOYSA-N |
| Mol Weight | 296.41 g/mol |
| Molecular Formula | C20H24O2 |
| Exact Mass | 296.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Yc3Ql7sPrV |
|---|---|
| Name | 1-(2-(3,3-Dimethylbut-1-ynyl)phenyl)prop-2-ynyl pivalate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.177630011 u |
| Formula | C20H24O2 |
| InChI | InChI=1S/C20H24O2/c1-8-17(22-18(21)20(5,6)7)16-12-10-9-11-15(16)13-14-19(2,3)4/h1,9-12,17H,2-7H3 |
| InChIKey | HMEHNWJIFLPVGL-UHFFFAOYSA-N |
| SMILES | C(#CC(C)(C)C)C1=C(C(OC(C(C)(C)C)=O)C#C)C=CC=C1 |