| SpectraBase Compound ID | 4t2Wj4DcyCx |
|---|---|
| InChI | InChI=1S/C12H14BrNO3/c13-10-1-3-11(4-2-10)17-9-12(15)14-5-7-16-8-6-14/h1-4H,5-9H2 |
| InChIKey | JPMSSCHKCHJVNB-UHFFFAOYSA-N |
| Mol Weight | 300.15 g/mol |
| Molecular Formula | C12H14BrNO3 |
| Exact Mass | 299.015706 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hi9dacGrPCn |
|---|---|
| Name | 2-(4-Bromo-phenoxy)-1-morpholin-4-yl-ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.015706312 u |
| Formula | C12H14BrNO3 |
| InChI | InChI=1S/C12H14BrNO3/c13-10-1-3-11(4-2-10)17-9-12(15)14-5-7-16-8-6-14/h1-4H,5-9H2 |
| InChIKey | JPMSSCHKCHJVNB-UHFFFAOYSA-N |
| Molecular Weight | 300.152 g/mol |
| SMILES | C=1(C=CC(OCC(N2CCOCC2)=O)=CC1)Br |