| SpectraBase Compound ID | C4FW6BAELYP |
|---|---|
| InChI | InChI=1S/C15H11ClO/c1-11(12-5-3-2-4-6-12)15(17)13-7-9-14(16)10-8-13/h2-10H,1H2 |
| InChIKey | XBBCDQHSQJHEMJ-UHFFFAOYSA-N |
| Mol Weight | 242.7 g/mol |
| Molecular Formula | C15H11ClO |
| Exact Mass | 242.049843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I08BNasFRN6 |
|---|---|
| Name | 1-(4-Chlorophenyl)-2-phenylprop-2-en-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.049842673 u |
| Formula | C15H11ClO |
| InChI | InChI=1S/C15H11ClO/c1-11(12-5-3-2-4-6-12)15(17)13-7-9-14(16)10-8-13/h2-10H,1H2 |
| InChIKey | XBBCDQHSQJHEMJ-UHFFFAOYSA-N |
| Molecular Weight | 242.705 g/mol |
| SMILES | C(C(C=1C=CC(=CC1)Cl)=O)(C1=CC=CC=C1)=C |