| SpectraBase Compound ID | I4337zZ4EHk |
|---|---|
| InChI | InChI=1S/C14H20O5/c1-4-9-14(10-7-8-11-15,12(16)18-5-2)13(17)19-6-3/h4,15H,1,5-6,9-11H2,2-3H3 |
| InChIKey | WPHFIMWRFBVMJL-UHFFFAOYSA-N |
| Mol Weight | 268.31 g/mol |
| Molecular Formula | C14H20O5 |
| Exact Mass | 268.131074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Q7llJEnllv |
|---|---|
| Name | 5,5-bis(Ethoxycarbonyl)oct-7-en-2-yn-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.131073739 u |
| Formula | C14H20O5 |
| InChI | InChI=1S/C14H20O5/c1-4-9-14(10-7-8-11-15,12(16)18-5-2)13(17)19-6-3/h4,15H,1,5-6,9-11H2,2-3H3 |
| InChIKey | WPHFIMWRFBVMJL-UHFFFAOYSA-N |
| Molecular Weight | 268.309 g/mol |
| SMILES | C(C#CCC(CC=C)(C(=O)OCC)C(=O)OCC)O |