![8-Bromobicyclo[5.1.0]octane](/api/spectrum/HVefTnfxP7e/structure.png?h=300&w=458 "8-Bromobicyclo[5.1.0]octane")
| SpectraBase Compound ID | FAMr6IkoRxg |
|---|---|
| InChI | InChI=1S/C8H13Br/c9-8-6-4-2-1-3-5-7(6)8/h6-8H,1-5H2 |
| InChIKey | RDEWJNLWKSBRBI-UHFFFAOYSA-N |
| Mol Weight | 189.1 g/mol |
| Molecular Formula | C8H13Br |
| Exact Mass | 188.020063 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HVefTnfxP7e |
|---|---|
| Name | 8-Bromobicyclo[5.1.0]octane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.020063419 u |
| Formula | C8H13Br |
| InChI | InChI=1S/C8H13Br/c9-8-6-4-2-1-3-5-7(6)8/h6-8H,1-5H2 |
| InChIKey | RDEWJNLWKSBRBI-UHFFFAOYSA-N |
| Molecular Weight | 189.096 g/mol |
| SMILES | C1CCCC2C(C1)C2Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.905169 |