| SpectraBase Compound ID | EnuC9tB7ucM |
|---|---|
| InChI | InChI=1S/C9H11Br2NO/c1-13-9-4-6(2-3-12)7(10)5-8(9)11/h4-5H,2-3,12H2,1H3 |
| InChIKey | UTGHEZKXSODWPO-UHFFFAOYSA-N |
| Mol Weight | 309.0 g/mol |
| Molecular Formula | C9H11Br2NO |
| Exact Mass | 306.92074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8vw1YCgh0Pw |
|---|---|
| Name | 2-(2,4-Dibromo-5-methoxy-phenyl)ethanamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.920739977 u |
| Formula | C9H11Br2NO |
| InChI | InChI=1S/C9H11Br2NO/c1-13-9-4-6(2-3-12)7(10)5-8(9)11/h4-5H,2-3,12H2,1H3 |
| InChIKey | UTGHEZKXSODWPO-UHFFFAOYSA-N |
| Molecular Weight | 309.001 g/mol |
| SMILES | C=1C(=C(OC)C=C(C1Br)CCN)Br |