| SpectraBase Compound ID | CI7V0K1wmo4 |
|---|---|
| InChI | InChI=1S/C15H12O/c1-2-14-10-6-7-11-15(14)16-12-13-8-4-3-5-9-13/h1,3-11H,12H2 |
| InChIKey | ONFVPGMZPQISCE-UHFFFAOYSA-N |
| Mol Weight | 208.26 g/mol |
| Molecular Formula | C15H12O |
| Exact Mass | 208.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1uni8iAPSVQ |
|---|---|
| Name | 1-Benzoxy-2-ethynyl-benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.088815005 u |
| Formula | C15H12O |
| InChI | InChI=1S/C15H12O/c1-2-14-10-6-7-11-15(14)16-12-13-8-4-3-5-9-13/h1,3-11H,12H2 |
| InChIKey | ONFVPGMZPQISCE-UHFFFAOYSA-N |
| Molecular Weight | 208.260 g/mol |
| SMILES | C(#C)C=1C(OCC=2C=CC=CC2)=CC=CC1 |