| SpectraBase Compound ID | ILflhX1p6PC |
|---|---|
| InChI | InChI=1S/C8H5Cl4NO/c9-5-2-1-3-6(4-5)13-7(14)8(10,11)12/h1-4H,(H,13,14) |
| InChIKey | ZCNFWVGKVHRKCD-UHFFFAOYSA-N |
| Mol Weight | 272.9 g/mol |
| Molecular Formula | C8H5Cl4NO |
| Exact Mass | 270.912525 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Cs6GaKIP5Xc |
|---|---|
| Name | 2,2,2,3'-Tetrachloroacetanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.912524584 u |
| Formula | C8H5Cl4NO |
| InChI | InChI=1S/C8H5Cl4NO/c9-5-2-1-3-6(4-5)13-7(14)8(10,11)12/h1-4H,(H,13,14) |
| InChIKey | ZCNFWVGKVHRKCD-UHFFFAOYSA-N |
| Molecular Weight | 272.946 g/mol |
| SMILES | N(C=1C=C(C=CC1)Cl)C(C(Cl)(Cl)Cl)=O |
| Spectrum/Structure Validation Score (Raman) | 0.930697 |