| SpectraBase Compound ID | 9rWfn4aa74y |
|---|---|
| InChI | InChI=1S/C12H18O2/c1-5-7-11(14-10-6-2)8-9-12(3,4)13/h2,11,13H,5,7,10H2,1,3-4H3 |
| InChIKey | LIJHUSOQVLXXFY-UHFFFAOYSA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 64XLcYunLYz |
|---|---|
| Name | 2-Methyl-5-prop-2-ynoxy-oct-3-yn-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.130679818 u |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c1-5-7-11(14-10-6-2)8-9-12(3,4)13/h2,11,13H,5,7,10H2,1,3-4H3 |
| InChIKey | LIJHUSOQVLXXFY-UHFFFAOYSA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C(C#CC(OCC#C)CCC)(O)(C)C |