| SpectraBase Compound ID | 8TfXgwpHt4c |
|---|---|
| InChI | InChI=1S/C12H15BrO2/c1-10(13)12(14)15-9-5-8-11-6-3-2-4-7-11/h2-4,6-7,10H,5,8-9H2,1H3 |
| InChIKey | YJTZEGOKVPMDIV-UHFFFAOYSA-N |
| Mol Weight | 271.15 g/mol |
| Molecular Formula | C12H15BrO2 |
| Exact Mass | 270.025543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1YXkaPnbAOQ |
|---|---|
| Name | 2-Bromopropionic acid, 3-phenylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.025542721 u |
| Formula | C12H15BrO2 |
| InChI | InChI=1S/C12H15BrO2/c1-10(13)12(14)15-9-5-8-11-6-3-2-4-7-11/h2-4,6-7,10H,5,8-9H2,1H3 |
| InChIKey | YJTZEGOKVPMDIV-UHFFFAOYSA-N |
| SMILES | C1(=CC=CC=C1)CCCOC(C(C)Br)=O |