| SpectraBase Compound ID | JHYXjGCdGQs |
|---|---|
| InChI | InChI=1S/C11H11ClO/c1-9(13)3-2-4-10-5-7-11(12)8-6-10/h5-9,13H,3H2,1H3 |
| InChIKey | FQAXMDQIDIFVIM-UHFFFAOYSA-N |
| Mol Weight | 194.66 g/mol |
| Molecular Formula | C11H11ClO |
| Exact Mass | 194.049843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I3PxHZoMyuR |
|---|---|
| Name | 5-(4-Chlorophenyl)-4-pentyn-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.049842673 u |
| Formula | C11H11ClO |
| InChI | InChI=1S/C11H11ClO/c1-9(13)3-2-4-10-5-7-11(12)8-6-10/h5-9,13H,3H2,1H3 |
| InChIKey | FQAXMDQIDIFVIM-UHFFFAOYSA-N |
| Molecular Weight | 194.661 g/mol |
| SMILES | OC(CC#CC1=CC=C(C=C1)Cl)C |