| SpectraBase Compound ID | 6UyoyPLPjsu |
|---|---|
| InChI | InChI=1S/C13H7Cl3O/c14-9-3-1-8(2-4-9)13(17)11-6-5-10(15)7-12(11)16/h1-7H |
| InChIKey | CRMBMVSEYHSLBN-UHFFFAOYSA-N |
| Mol Weight | 285.56 g/mol |
| Molecular Formula | C13H7Cl3O |
| Exact Mass | 283.956248 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2BWlAoVDDZZ |
|---|---|
| Name | Methanone, (4-chlorophenyl)(2,4-dichlorophenyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.956247944 u |
| Formula | C13H7Cl3O |
| InChI | InChI=1S/C13H7Cl3O/c14-9-3-1-8(2-4-9)13(17)11-6-5-10(15)7-12(11)16/h1-7H |
| InChIKey | CRMBMVSEYHSLBN-UHFFFAOYSA-N |
| SMILES | C1(=C(C=CC(=C1)Cl)C(C1=CC=C(C=C1)Cl)=O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.936439 |