![7,7-Dibromo-8-oxo-1-azabicyclo[4.2.0]ocatane](/api/spectrum/LG5KJD6tJw7/structure.png?h=300&w=458 "7,7-Dibromo-8-oxo-1-azabicyclo[4.2.0]ocatane")
| SpectraBase Compound ID | 8fSw0uE0kXA |
|---|---|
| InChI | InChI=1S/C7H9Br2NO/c8-7(9)5-3-1-2-4-10(5)6(7)11/h5H,1-4H2 |
| InChIKey | QYPQYRFPVIKHFN-UHFFFAOYSA-N |
| Mol Weight | 282.96 g/mol |
| Molecular Formula | C7H9Br2NO |
| Exact Mass | 280.90509 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LG5KJD6tJw7 |
|---|---|
| Name | 7,7-Dibromo-8-oxo-1-azabicyclo[4.2.0]ocatane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.905089913 u |
| Formula | C7H9Br2NO |
| InChI | InChI=1S/C7H9Br2NO/c8-7(9)5-3-1-2-4-10(5)6(7)11/h5H,1-4H2 |
| InChIKey | QYPQYRFPVIKHFN-UHFFFAOYSA-N |
| SMILES | C1(C(=O)N2C1CCCC2)(Br)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.825045 |