| SpectraBase Compound ID | Eji38Bw6hkC |
|---|---|
| InChI | InChI=1S/C12H14BrNO2/c1-7-5-11(13)12(6-8(7)2)14(9(3)15)10(4)16/h5-6H,1-4H3 |
| InChIKey | UZCQKCRXEBYKKV-UHFFFAOYSA-N |
| Mol Weight | 284.15 g/mol |
| Molecular Formula | C12H14BrNO2 |
| Exact Mass | 283.020792 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Bxo5D5GBvoz |
|---|---|
| Name | N-(2-Bromo-4,5-dimethylphenyl)acetamide, N-acetyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.020791693 u |
| Formula | C12H14BrNO2 |
| InChI | InChI=1S/C12H14BrNO2/c1-7-5-11(13)12(6-8(7)2)14(9(3)15)10(4)16/h5-6H,1-4H3 |
| InChIKey | UZCQKCRXEBYKKV-UHFFFAOYSA-N |
| SMILES | C1(Br)=C(C=C(C(=C1)C)C)N(C(=O)C)C(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952157 |