| SpectraBase Compound ID | J2h4hWM4CPS |
|---|---|
| InChI | InChI=1S/C9H9Br2NO/c10-6-5-9(13)12-8-3-1-7(11)2-4-8/h1-4H,5-6H2,(H,12,13) |
| InChIKey | ZFUGLAQIZREBFH-UHFFFAOYSA-N |
| Mol Weight | 306.99 g/mol |
| Molecular Formula | C9H9Br2NO |
| Exact Mass | 304.90509 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Fxz0Dxj9l68 |
|---|---|
| Name | N-(4-Bromophenyl)-3-bromopropanamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.905089913 u |
| Formula | C9H9Br2NO |
| InChI | InChI=1S/C9H9Br2NO/c10-6-5-9(13)12-8-3-1-7(11)2-4-8/h1-4H,5-6H2,(H,12,13) |
| InChIKey | ZFUGLAQIZREBFH-UHFFFAOYSA-N |
| Molecular Weight | 306.985 g/mol |
| SMILES | C(NC=1C=CC(=CC1)Br)(CCBr)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.908094 |