| SpectraBase Compound ID | LDPyQlLIlWe |
|---|---|
| InChI | InChI=1S/C6H11Cl2NO/c1-2-3-4-9-6(10)5(7)8/h5H,2-4H2,1H3,(H,9,10) |
| InChIKey | JBYXKEJXXFUJKU-UHFFFAOYSA-N |
| Mol Weight | 184.07 g/mol |
| Molecular Formula | C6H11Cl2NO |
| Exact Mass | 183.021769 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Ch2U9eVeNpd |
|---|---|
| Name | Dichloroacetamide, N-butyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.021769377 u |
| Formula | C6H11Cl2NO |
| InChI | InChI=1S/C6H11Cl2NO/c1-2-3-4-9-6(10)5(7)8/h5H,2-4H2,1H3,(H,9,10) |
| InChIKey | JBYXKEJXXFUJKU-UHFFFAOYSA-N |
| Molecular Weight | 184.066 g/mol |
| SMILES | C(C(Cl)Cl)(NCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.926459 |