| SpectraBase Compound ID | EgQDlEDqXnV |
|---|---|
| InChI | InChI=1S/C17H18BrNO2/c1-11-8-12(2)10-16(9-11)21-13(3)17(20)19-15-6-4-14(18)5-7-15/h4-10,13H,1-3H3,(H,19,20) |
| InChIKey | AQYBRIQSXHIPRC-UHFFFAOYSA-N |
| Mol Weight | 348.24 g/mol |
| Molecular Formula | C17H18BrNO2 |
| Exact Mass | 347.052092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 39Ce6A9QdGc |
|---|---|
| Name | N-(4-Bromophenyl)-2-(3,5-dimethylphenoxy)propanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 347.052091822 u |
| Formula | C17H18BrNO2 |
| InChI | InChI=1S/C17H18BrNO2/c1-11-8-12(2)10-16(9-11)21-13(3)17(20)19-15-6-4-14(18)5-7-15/h4-10,13H,1-3H3,(H,19,20) |
| InChIKey | AQYBRIQSXHIPRC-UHFFFAOYSA-N |
| Molecular Weight | 348.240 g/mol |
| SMILES | N(C1=CC=C(C=C1)Br)C(C(OC=1C=C(C=C(C1)C)C)C)=O |