| SpectraBase Compound ID | LUD1pNAbyOP |
|---|---|
| InChI | InChI=1S/C12H22O3/c1-6-14-11(15-7-2)9-8-10(13)12(3,4)5/h10-11,13H,6-7H2,1-5H3 |
| InChIKey | PHWKRIVYEQOMIJ-UHFFFAOYSA-N |
| Mol Weight | 214.3 g/mol |
| Molecular Formula | C12H22O3 |
| Exact Mass | 214.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JUQ9zwvnIsP |
|---|---|
| Name | 6,6-Diethoxy-2,2-dimethyl-4-hexyn-3-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.156894565 u |
| Formula | C12H22O3 |
| InChI | InChI=1S/C12H22O3/c1-6-14-11(15-7-2)9-8-10(13)12(3,4)5/h10-11,13H,6-7H2,1-5H3 |
| InChIKey | PHWKRIVYEQOMIJ-UHFFFAOYSA-N |
| Molecular Weight | 214.305 g/mol |
| SMILES | C(#CC(OCC)OCC)C(C(C)(C)C)O |