| SpectraBase Compound ID | 2y4skdFD6AH |
|---|---|
| InChI | InChI=1S/C21H14O/c22-21(19-12-5-2-6-13-19)20-14-8-7-11-18(20)16-15-17-9-3-1-4-10-17/h1-14H |
| InChIKey | ZDMBWRVNJKHIAV-UHFFFAOYSA-N |
| Mol Weight | 282.34 g/mol |
| Molecular Formula | C21H14O |
| Exact Mass | 282.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bz0J1rEURqc |
|---|---|
| Name | 2-(2-Phenylethynyl)benzophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.104465070 u |
| Formula | C21H14O |
| InChI | InChI=1S/C21H14O/c22-21(19-12-5-2-6-13-19)20-14-8-7-11-18(20)16-15-17-9-3-1-4-10-17/h1-14H |
| InChIKey | ZDMBWRVNJKHIAV-UHFFFAOYSA-N |
| SMILES | C(#CC=1C=CC=CC1)C=1C(C(=O)C2=CC=CC=C2)=CC=CC1 |