| SpectraBase Compound ID | GDvqDAvMCAt |
|---|---|
| InChI | InChI=1S/C7H11BrO2/c1-6(2)7(9)10-5-3-4-8/h1,3-5H2,2H3 |
| InChIKey | QAEFQMLTVALDSP-UHFFFAOYSA-N |
| Mol Weight | 207.07 g/mol |
| Molecular Formula | C7H11BrO2 |
| Exact Mass | 205.994243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G9Y78ecVr2k |
|---|---|
| Name | 2-Propenoic acid, 2-methyl-, 3-bromopropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.994242592 u |
| Formula | C7H11BrO2 |
| InChI | InChI=1S/C7H11BrO2/c1-6(2)7(9)10-5-3-4-8/h1,3-5H2,2H3 |
| InChIKey | QAEFQMLTVALDSP-UHFFFAOYSA-N |
| Molecular Weight | 207.067 g/mol |
| SMILES | CC(=C)C(=O)OCCCBr |