| SpectraBase Compound ID | A7MHQKLVcGh |
|---|---|
| InChI | InChI=1S/C14H28ClNO/c1-3-5-7-9-11-16(14(17)13-15)12-10-8-6-4-2/h3-13H2,1-2H3 |
| InChIKey | ZGQVQRKCUZEQLW-UHFFFAOYSA-N |
| Mol Weight | 261.84 g/mol |
| Molecular Formula | C14H28ClNO |
| Exact Mass | 261.185942 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3zowbGitWJ4 |
|---|---|
| Name | Chloroacetamide, N,N-dihexyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.185942225 u |
| Formula | C14H28ClNO |
| InChI | InChI=1S/C14H28ClNO/c1-3-5-7-9-11-16(14(17)13-15)12-10-8-6-4-2/h3-13H2,1-2H3 |
| InChIKey | ZGQVQRKCUZEQLW-UHFFFAOYSA-N |
| Molecular Weight | 261.837 g/mol |
| SMILES | C(C(N(CCCCCC)CCCCCC)=O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.98107 |