![1-[4'-(Hydroxyphenyl]pent-4-ene-1-yne](/api/spectrum/19eA51A1aUc/structure.png?h=300&w=458 "1-[4'-(Hydroxyphenyl]pent-4-ene-1-yne")
| SpectraBase Compound ID | AQxCAdFRFQy |
|---|---|
| InChI | InChI=1S/C17H14O/c18-17-13-11-16(12-14-17)10-6-2-5-9-15-7-3-1-4-8-15/h1,3-5,7-9,11-14,18H,2H2/b9-5+ |
| InChIKey | KUDWWMUIRZBCKO-WEVVVXLNSA-N |
| Mol Weight | 234.3 g/mol |
| Molecular Formula | C17H14O |
| Exact Mass | 234.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 19eA51A1aUc |
|---|---|
| Name | 1-[4'-(Hydroxyphenyl]pent-4-ene-1-yne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.104465070 u |
| Formula | C17H14O |
| InChI | InChI=1S/C17H14O/c18-17-13-11-16(12-14-17)10-6-2-5-9-15-7-3-1-4-8-15/h1,3-5,7-9,11-14,18H,2H2/b9-5+ |
| InChIKey | KUDWWMUIRZBCKO-WEVVVXLNSA-N |
| Molecular Weight | 234.298 g/mol |
| SMILES | C1(O)=CC=C(C=C1)C#CC\C=C\C1=CC=CC=C1 |