SpectraBase Compound ID | 2WFZWBk4NSe |
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InChI | InChI=1S/C14H11Cl2NO/c15-12-7-6-11(9-13(12)16)17-14(18)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,17,18) |
InChIKey | WOLDJAKASQLODM-UHFFFAOYSA-N |
Mol Weight | 280.15 g/mol |
Molecular Formula | C14H11Cl2NO |
Exact Mass | 279.021769 g/mol |
SpectraBase Spectrum ID | Grp8r2nnLLs |
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Name | 3',4'-Dichlorophenylacetanilide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 279.021769377 u |
Formula | C14H11Cl2NO |
InChI | InChI=1S/C14H11Cl2NO/c15-12-7-6-11(9-13(12)16)17-14(18)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,17,18) |
InChIKey | WOLDJAKASQLODM-UHFFFAOYSA-N |
SMILES | C1=CC=C(C=C1)CC(=O)NC1=CC=C(C(=C1)Cl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.892506 |