| SpectraBase Compound ID | EuwTw6DA2ZO |
|---|---|
| InChI | InChI=1S/C17H20O3/c1-13(2)6-5-7-14(3)8-9-17(20-15(4)18)16-10-11-19-12-16/h6,8,10-12,17H,9H2,1-4H3/b14-8+ |
| InChIKey | ATKCVTLMPCIZFF-RIYZIHGNSA-N |
| Mol Weight | 272.34 g/mol |
| Molecular Formula | C17H20O3 |
| Exact Mass | 272.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2RZJNtEmKOD |
|---|---|
| Name | (+-)-(+)-(-)-(E)-1-(3-furyl)-4,8-dimethylnona-3,7-dien-5-yn-1-yl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.141244501 u |
| Formula | C17H20O3 |
| InChI | InChI=1S/C17H20O3/c1-13(2)6-5-7-14(3)8-9-17(20-15(4)18)16-10-11-19-12-16/h6,8,10-12,17H,9H2,1-4H3/b14-8+ |
| InChIKey | ATKCVTLMPCIZFF-RIYZIHGNSA-N |
| SMILES | C(C)(=O)OC(C\C=C\(C#CC=C(C)C)C)C1=COC=C1 |