| SpectraBase Compound ID | FcCwTGAmwCw |
|---|---|
| InChI | InChI=1S/C8H13BrO2/c1-6(9)8(10)11-7-4-2-3-5-7/h6-7H,2-5H2,1H3 |
| InChIKey | DGVQLOJHXPGWPE-UHFFFAOYSA-N |
| Mol Weight | 221.09 g/mol |
| Molecular Formula | C8H13BrO2 |
| Exact Mass | 220.009893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KCRFl1yk17r |
|---|---|
| Name | 2-Bromopropionic acid, cyclopentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.009892657 u |
| Formula | C8H13BrO2 |
| InChI | InChI=1S/C8H13BrO2/c1-6(9)8(10)11-7-4-2-3-5-7/h6-7H,2-5H2,1H3 |
| InChIKey | DGVQLOJHXPGWPE-UHFFFAOYSA-N |
| Molecular Weight | 221.094 g/mol |
| SMILES | C1(CCCC1)OC(C(C)Br)=O |