| SpectraBase Compound ID | JPYXp9DO6Lc |
|---|---|
| InChI | InChI=1S/C11H12O/c1-3-9(2)11(12)10-7-5-4-6-8-10/h1,4-9,11-12H,2H3 |
| InChIKey | LVFDXDVJFHWDFY-UHFFFAOYSA-N |
| Mol Weight | 160.22 g/mol |
| Molecular Formula | C11H12O |
| Exact Mass | 160.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IjzAGIAeOMG |
|---|---|
| Name | 2-Methyl-1-phenyl-3-butyn-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.088815005 u |
| Formula | C11H12O |
| InChI | InChI=1S/C11H12O/c1-3-9(2)11(12)10-7-5-4-6-8-10/h1,4-9,11-12H,2H3 |
| InChIKey | LVFDXDVJFHWDFY-UHFFFAOYSA-N |
| Molecular Weight | 160.216 g/mol |
| SMILES | C(#C)C(C(C=1C=CC=CC1)O)C |