| SpectraBase Compound ID | 7YERPy8FZZg |
|---|---|
| InChI | InChI=1S/C11H22BrNO/c1-4-6-7-9-13(8-5-2)11(14)10(3)12/h10H,4-9H2,1-3H3 |
| InChIKey | ODNULANPZQOXTE-UHFFFAOYSA-N |
| Mol Weight | 264.21 g/mol |
| Molecular Formula | C11H22BrNO |
| Exact Mass | 263.088477 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ITUa7PWDoQN |
|---|---|
| Name | Propionamide, 2-bromo-N-propyl-N-pentyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.088477331 u |
| Formula | C11H22BrNO |
| InChI | InChI=1S/C11H22BrNO/c1-4-6-7-9-13(8-5-2)11(14)10(3)12/h10H,4-9H2,1-3H3 |
| InChIKey | ODNULANPZQOXTE-UHFFFAOYSA-N |
| Molecular Weight | 264.207 g/mol |
| SMILES | C(N(CCCCC)CCC)(=O)C(C)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.849598 |