| SpectraBase Compound ID | 6a24fy5mWe9 |
|---|---|
| InChI | InChI=1S/C9H10Br2/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5,9H,6-7H2 |
| InChIKey | RSAHLRQANLPURU-UHFFFAOYSA-N |
| Mol Weight | 277.99 g/mol |
| Molecular Formula | C9H10Br2 |
| Exact Mass | 275.914926 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3e0rFFWrgE3 |
|---|---|
| Name | Benzene, (1,3-dibromopropyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.914926322 u |
| Formula | C9H10Br2 |
| InChI | InChI=1S/C9H10Br2/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5,9H,6-7H2 |
| InChIKey | RSAHLRQANLPURU-UHFFFAOYSA-N |
| Molecular Weight | 277.987 g/mol |
| SMILES | C1=CC=CC(=C1)C(CCBr)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97438 |