| SpectraBase Compound ID | H3TNcGXEXUe |
|---|---|
| InChI | InChI=1S/C11H12O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8,11-12H,9H2,1H3 |
| InChIKey | ICTFKUCLZIQZEY-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 | 9YaY7ORBcUz |
|---|---|
| Name | 1-Phenyl-3-pentyn-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/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8,11-12H,9H2,1H3 |
| InChIKey | ICTFKUCLZIQZEY-UHFFFAOYSA-N |
| Molecular Weight | 160.216 g/mol |
| SMILES | C(#CC)CC(C=1C=CC=CC1)O |