![2-[2-(4-Methoxyphenyl)ethynyl]phenol](/api/spectrum/47BUssm7xuH/structure.png?h=300&w=458 "2-[2-(4-Methoxyphenyl)ethynyl]phenol")
| SpectraBase Compound ID | 1exNsf3jxiW |
|---|---|
| InChI | InChI=1S/C15H12O2/c1-17-14-10-7-12(8-11-14)6-9-13-4-2-3-5-15(13)16/h2-5,7-8,10-11,16H,1H3 |
| InChIKey | MLVVJDUWZUANHH-UHFFFAOYSA-N |
| Mol Weight | 224.26 g/mol |
| Molecular Formula | C15H12O2 |
| Exact Mass | 224.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 47BUssm7xuH |
|---|---|
| Name | 2-[2-(4-Methoxyphenyl)ethynyl]phenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.083729624 u |
| Formula | C15H12O2 |
| InChI | InChI=1S/C15H12O2/c1-17-14-10-7-12(8-11-14)6-9-13-4-2-3-5-15(13)16/h2-5,7-8,10-11,16H,1H3 |
| InChIKey | MLVVJDUWZUANHH-UHFFFAOYSA-N |
| Molecular Weight | 224.259 g/mol |
| SMILES | C=1(C(=CC=CC1)C#CC=1C=CC(=CC1)OC)O |