| SpectraBase Compound ID | KzaasibiuE8 |
|---|---|
| InChI | InChI=1S/C12H23Br/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h12H,1-11H2 |
| InChIKey | IADKAKQBSKWITE-UHFFFAOYSA-N |
| Mol Weight | 247.22 g/mol |
| Molecular Formula | C12H23Br |
| Exact Mass | 246.098314 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2KFRFh9N4OU |
|---|---|
| Name | Bromocyclododecane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.098313741 u |
| Formula | C12H23Br |
| InChI | InChI=1S/C12H23Br/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h12H,1-11H2 |
| InChIKey | IADKAKQBSKWITE-UHFFFAOYSA-N |
| Molecular Weight | 247.220 g/mol |
| SMILES | C1CCCCCC(CCCCC1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.917128 |