| SpectraBase Compound ID | ASmwOMaa00Z |
|---|---|
| InChI | InChI=1S/C13H15BrO2/c1-2-3-4-5-10-16-13(15)11-6-8-12(14)9-7-11/h5-10H,2-4H2,1H3/b10-5+ |
| InChIKey | POJPDYSWUGHAMC-BJMVGYQFSA-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 | Gbtx5lxbCEp |
|---|---|
| Name | (E)-hex-1-Enyl 4-bromobenzoate |
| 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/c1-2-3-4-5-10-16-13(15)11-6-8-12(14)9-7-11/h5-10H,2-4H2,1H3/b10-5+ |
| InChIKey | POJPDYSWUGHAMC-BJMVGYQFSA-N |
| SMILES | CCCC\C=C\OC(C1=CC=C(C=C1)Br)=O |