| SpectraBase Compound ID | DsUSeuukdZd |
|---|---|
| InChI | InChI=1S/C13H15BrO2/c1-2-3-9-16-10-8-13(15)11-4-6-12(14)7-5-11/h4-8,10H,2-3,9H2,1H3/b10-8+ |
| InChIKey | YKHIMYGLIVQMIZ-CSKARUKUSA-N |
| Mol Weight | 283.17 g/mol |
| Molecular Formula | C13H15BrO2 |
| Exact Mass | 282.025543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 455WDxoIjf3 |
|---|---|
| Name | 2-Propen-1-one, 1-(4-bromophenyl)-3-butoxy-, (E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.025542721 u |
| Formula | C13H15BrO2 |
| InChI | InChI=1S/C13H15BrO2/c1-2-3-9-16-10-8-13(15)11-4-6-12(14)7-5-11/h4-8,10H,2-3,9H2,1H3/b10-8+ |
| InChIKey | YKHIMYGLIVQMIZ-CSKARUKUSA-N |
| SMILES | C(\C=C\OCCCC)(C=1C=CC(=CC1)Br)=O |