| SpectraBase Compound ID | D7YldlRnuTL |
|---|---|
| InChI | InChI=1S/C18H17ClO/c1-2-5-18(20)17-7-4-3-6-15(17)11-8-14-9-12-16(19)13-10-14/h3-4,6-13H,2,5H2,1H3/b11-8+ |
| InChIKey | SGFKGYMZBJWUJX-DHZHZOJOSA-N |
| Mol Weight | 284.79 g/mol |
| Molecular Formula | C18H17ClO |
| Exact Mass | 284.096793 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EZTRanlN5wM |
|---|---|
| Name | (E)-1-(2-(4-Chlorostyryl)phenyl)butan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.096792866 u |
| Formula | C18H17ClO |
| InChI | InChI=1S/C18H17ClO/c1-2-5-18(20)17-7-4-3-6-15(17)11-8-14-9-12-16(19)13-10-14/h3-4,6-13H,2,5H2,1H3/b11-8+ |
| InChIKey | SGFKGYMZBJWUJX-DHZHZOJOSA-N |
| SMILES | C=1(\C=C\C=2C(C(=O)CCC)=CC=CC2)C=CC(Cl)=CC1 |