| SpectraBase Compound ID | IEuv8ocJu0Q |
|---|---|
| InChI | InChI=1S/C16H11F3O/c17-16(18,19)14-9-6-12(7-10-14)8-11-15(20)13-4-2-1-3-5-13/h1-11H/b11-8+ |
| InChIKey | QZMAQARJRMCAPU-DHZHZOJOSA-N |
| Mol Weight | 276.26 g/mol |
| Molecular Formula | C16H11F3O |
| Exact Mass | 276.076199 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ss35fFM8Pe |
|---|---|
| Name | (E)-1-Phenyl-3-(4-trifluoromethylphenyl)prop-2-en-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.076199462 u |
| Formula | C16H11F3O |
| InChI | InChI=1S/C16H11F3O/c17-16(18,19)14-9-6-12(7-10-14)8-11-15(20)13-4-2-1-3-5-13/h1-11H/b11-8+ |
| InChIKey | QZMAQARJRMCAPU-DHZHZOJOSA-N |
| Molecular Weight | 276.258 g/mol |
| SMILES | C(C=1C=CC(\C=C\C(=O)C2=CC=CC=C2)=CC1)(F)(F)F |