| SpectraBase Compound ID | K4oKXEqJP4j |
|---|---|
| InChI | InChI=1S/C15H15BrN2O2/c1-2-11-3-6-13(7-4-11)20-10-15(19)18-14-8-5-12(16)9-17-14/h3-9H,2,10H2,1H3,(H,17,18,19) |
| InChIKey | BONAMQPXMAGMMW-UHFFFAOYSA-N |
| Mol Weight | 335.2 g/mol |
| Molecular Formula | C15H15BrN2O2 |
| Exact Mass | 334.031691 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BmYEh99MvrG |
|---|---|
| Name | Acetamide, 2-(4-ethylphenoxy)-N-(5-bromopyrid-2-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.031690729 u |
| Formula | C15H15BrN2O2 |
| InChI | InChI=1S/C15H15BrN2O2/c1-2-11-3-6-13(7-4-11)20-10-15(19)18-14-8-5-12(16)9-17-14/h3-9H,2,10H2,1H3,(H,17,18,19) |
| InChIKey | BONAMQPXMAGMMW-UHFFFAOYSA-N |
| Molecular Weight | 335.201 g/mol |
| SMILES | CCC1=CC=C(OCC(NC2=NC=C(C=C2)Br)=O)C=C1 |