| SpectraBase Compound ID | XcLIA4oXQw |
|---|---|
| InChI | InChI=1S/C14H8Cl2O2/c15-11-7-6-10(8-17)13(16)12(11)14(18)9-4-2-1-3-5-9/h1-8H |
| InChIKey | IHHONJLHTAQJOI-UHFFFAOYSA-N |
| Mol Weight | 279.12 g/mol |
| Molecular Formula | C14H8Cl2O2 |
| Exact Mass | 277.990135 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | IQLyEmniLDa |
|---|---|
| Name | 3-Benzoyl-2,4-dichlorobenzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.990134896 u |
| Formula | C14H8Cl2O2 |
| InChI | InChI=1S/C14H8Cl2O2/c15-11-7-6-10(8-17)13(16)12(11)14(18)9-4-2-1-3-5-9/h1-8H |
| InChIKey | IHHONJLHTAQJOI-UHFFFAOYSA-N |
| SMILES | C=1C(=C(C(=C(C1)Cl)C(C=1C=CC=CC1)=O)Cl)C=O |
| Spectrum/Structure Validation Score (Raman) | 0.703637 |