| SpectraBase Compound ID | ImPT07qUTky |
|---|---|
| InChI | InChI=1S/C6H12BrNO/c1-3-8(4-2)6(9)5-7/h3-5H2,1-2H3 |
| InChIKey | LHNPENNQGSGOTO-UHFFFAOYSA-N |
| Mol Weight | 194.07 g/mol |
| Molecular Formula | C6H12BrNO |
| Exact Mass | 193.010227 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 905i0E2KNe5 |
|---|---|
| Name | 2-Bromo-N,N-diethylacetamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.010227009 u |
| Formula | C6H12BrNO |
| InChI | InChI=1S/C6H12BrNO/c1-3-8(4-2)6(9)5-7/h3-5H2,1-2H3 |
| InChIKey | LHNPENNQGSGOTO-UHFFFAOYSA-N |
| Molecular Weight | 194.072 g/mol |
| SMILES | C(Br)C(=O)N(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959272 |