| SpectraBase Compound ID | A0QeoDc8dhU |
|---|---|
| InChI | InChI=1S/C9H10BrNO/c1-7(10)9(12)11-8-5-3-2-4-6-8/h2-7H,1H3,(H,11,12) |
| InChIKey | OPPUMGDCQYPOSM-UHFFFAOYSA-N |
| Mol Weight | 228.09 g/mol |
| Molecular Formula | C9H10BrNO |
| Exact Mass | 226.994577 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Bf3fDLEiUF9 |
|---|---|
| Name | 2-Bromo-N-phenyl-propionamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.994576945 u |
| Formula | C9H10BrNO |
| InChI | InChI=1S/C9H10BrNO/c1-7(10)9(12)11-8-5-3-2-4-6-8/h2-7H,1H3,(H,11,12) |
| InChIKey | OPPUMGDCQYPOSM-UHFFFAOYSA-N |
| Molecular Weight | 228.089 g/mol |
| SMILES | C(=O)(NC=1C=CC=CC1)C(Br)C |
| Spectrum/Structure Validation Score (Raman) | 0.980311 |