| SpectraBase Compound ID | Kl3Z9paTobX |
|---|---|
| InChI | InChI=1S/C9H18ClNO/c1-8(2)5-7-11-9(12)4-3-6-10/h8H,3-7H2,1-2H3,(H,11,12) |
| InChIKey | BILFILGVLKEIBF-UHFFFAOYSA-N |
| Mol Weight | 191.7 g/mol |
| Molecular Formula | C9H18ClNO |
| Exact Mass | 191.107692 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HfSZMxQjBth |
|---|---|
| Name | Butyramide, 4-chloro-N-3-methylbutyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 191.107691903 u |
| Formula | C9H18ClNO |
| InChI | InChI=1S/C9H18ClNO/c1-8(2)5-7-11-9(12)4-3-6-10/h8H,3-7H2,1-2H3,(H,11,12) |
| InChIKey | BILFILGVLKEIBF-UHFFFAOYSA-N |
| Molecular Weight | 191.702 g/mol |
| SMILES | C(CCCCl)(NCCC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.930312 |