SpectraBase Compound ID | HgjRyh8fF3F |
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InChI | InChI=1S/C8H5Cl4NO/c9-3-6(14)13-5-2-1-4(10)7(11)8(5)12/h1-2H,3H2,(H,13,14) |
InChIKey | SBKZGZXUOHBGOK-UHFFFAOYSA-N |
Mol Weight | 272.9 g/mol |
Molecular Formula | C8H5Cl4NO |
Exact Mass | 270.912525 g/mol |
SpectraBase Spectrum ID | 2SfN1v2vq9s |
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Name | 2-Chloranyl-N-[2,3,4-tris(chloranyl)phenyl]ethanamide |
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/c9-3-6(14)13-5-2-1-4(10)7(11)8(5)12/h1-2H,3H2,(H,13,14) |
InChIKey | SBKZGZXUOHBGOK-UHFFFAOYSA-N |
SMILES | C1(=C(C(Cl)=CC=C1NC(=O)CCl)Cl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.928175 |