| SpectraBase Compound ID | BxUfjdxcJky |
|---|---|
| InChI | InChI=1S/C17H16ClNO/c1-19(2)16-10-3-13(4-11-16)5-12-17(20)14-6-8-15(18)9-7-14/h3-12H,1-2H3 |
| InChIKey | WUXTYVHXWDGPIQ-UHFFFAOYSA-N |
| Mol Weight | 285.77 g/mol |
| Molecular Formula | C17H16ClNO |
| Exact Mass | 285.092042 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KKrLEiQVdPf |
|---|---|
| Name | 4'-Chloro-4-(dimethylamino)chalcone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.092041838 u |
| Formula | C17H16ClNO |
| InChI | InChI=1S/C17H16ClNO/c1-19(2)16-10-3-13(4-11-16)5-12-17(20)14-6-8-15(18)9-7-14/h3-12H,1-2H3 |
| InChIKey | WUXTYVHXWDGPIQ-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=C(C1)Cl)C(C=CC=1C=CC(=CC1)N(C)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.916082 |