| SpectraBase Compound ID | IiVLCBeM37l |
|---|---|
| InChI | InChI=1S/C6HBr5/c7-2-1-3(8)5(10)6(11)4(2)9/h1H |
| InChIKey | LLVVSBBXENOOQY-UHFFFAOYSA-N |
| Mol Weight | 472.59 g/mol |
| Molecular Formula | C6HBr5 |
| Exact Mass | 467.599515 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3s2pgfsH1dG |
|---|---|
| Name | Benzene, pentabromo- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 467.599515032 u |
| Formula | C6HBr5 |
| InChI | InChI=1S/C6HBr5/c7-2-1-3(8)5(10)6(11)4(2)9/h1H |
| InChIKey | LLVVSBBXENOOQY-UHFFFAOYSA-N |
| Molecular Weight | 472.594 g/mol |
| SMILES | C1=C(C(=C(C(=C1Br)Br)Br)Br)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940587 |