| SpectraBase Compound ID | ePbijN8ffZ |
|---|---|
| InChI | InChI=1S/C11H12O/c1-10(12)6-5-9-11-7-3-2-4-8-11/h2-4,7-8,10,12H,6H2,1H3 |
| InChIKey | NMXNYNOQRGLEAE-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 | 60f7G9yKM9q |
|---|---|
| Name | 1-Phenyl-1-pentyn-4-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/c1-10(12)6-5-9-11-7-3-2-4-8-11/h2-4,7-8,10,12H,6H2,1H3 |
| InChIKey | NMXNYNOQRGLEAE-UHFFFAOYSA-N |
| Molecular Weight | 160.216 g/mol |
| SMILES | C1=CC(C#CCC(C)O)=CC=C1 |