![Ethanone, 1-[2-(2-bromoethyl)cyclohexyl]-](/api/spectrum/GaaP8n9OUWl/structure.png?h=300&w=458 "Ethanone, 1-[2-(2-bromoethyl)cyclohexyl]-")
| SpectraBase Compound ID | IlZW2kWhj0z |
|---|---|
| InChI | InChI=1S/C10H17BrO/c1-8(12)10-5-3-2-4-9(10)6-7-11/h9-10H,2-7H2,1H3 |
| InChIKey | YUXMDBMIWYNHGS-UHFFFAOYSA-N |
| Mol Weight | 233.15 g/mol |
| Molecular Formula | C10H17BrO |
| Exact Mass | 232.046278 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GaaP8n9OUWl |
|---|---|
| Name | Ethanone, 1-[2-(2-bromoethyl)cyclohexyl]- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.046278166 u |
| Formula | C10H17BrO |
| InChI | InChI=1S/C10H17BrO/c1-8(12)10-5-3-2-4-9(10)6-7-11/h9-10H,2-7H2,1H3 |
| InChIKey | YUXMDBMIWYNHGS-UHFFFAOYSA-N |
| Molecular Weight | 233.149 g/mol |
| SMILES | C1(C(=O)C)C(CCBr)CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.814362 |