| SpectraBase Compound ID | E6Rz5zz1fiy |
|---|---|
| InChI | InChI=1S/C13H14O2/c1-10(2)12(14)8-9-13(15)11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8+ |
| InChIKey | FLDIKYYFCJLZGN-CMDGGOBGSA-N |
| Mol Weight | 202.25 g/mol |
| Molecular Formula | C13H14O2 |
| Exact Mass | 202.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | INw8nSnI2nK |
|---|---|
| Name | 1-(iso-Butanoyl)-2-(benzoyl)ethylene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.099379689 u |
| Formula | C13H14O2 |
| InChI | InChI=1S/C13H14O2/c1-10(2)12(14)8-9-13(15)11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8+ |
| InChIKey | FLDIKYYFCJLZGN-CMDGGOBGSA-N |
| Molecular Weight | 202.253 g/mol |
| SMILES | C(\C=C\C(=O)C=1C=CC=CC1)(=O)C(C)C |