| SpectraBase Compound ID | 7b6LfmEDSz3 |
|---|---|
| InChI | InChI=1S/C7H14BrNO/c1-3-5-9-7(10)6(8)4-2/h6H,3-5H2,1-2H3,(H,9,10) |
| InChIKey | PMPILFKTSYNCDL-UHFFFAOYSA-N |
| Mol Weight | 208.1 g/mol |
| Molecular Formula | C7H14BrNO |
| Exact Mass | 207.025877 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GlPkGJXWmrr |
|---|---|
| Name | Butyramide, 2-bromo-N-propyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.025877074 u |
| Formula | C7H14BrNO |
| InChI | InChI=1S/C7H14BrNO/c1-3-5-9-7(10)6(8)4-2/h6H,3-5H2,1-2H3,(H,9,10) |
| InChIKey | PMPILFKTSYNCDL-UHFFFAOYSA-N |
| Molecular Weight | 208.099 g/mol |
| SMILES | C(=O)(NCCC)C(CC)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939086 |