| SpectraBase Compound ID | 7IAfCQVbw1V |
|---|---|
| InChI | InChI=1S/C10H17BrO2/c1-2-8-5-3-4-6-9(8)13-10(12)7-11/h8-9H,2-7H2,1H3 |
| InChIKey | RAYQKDHUHGGQRP-UHFFFAOYSA-N |
| Mol Weight | 249.15 g/mol |
| Molecular Formula | C10H17BrO2 |
| Exact Mass | 248.041193 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HCXQqIvjaSO |
|---|---|
| Name | Bromoacetic acid, 2-ethylcyclohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.041192785 u |
| Formula | C10H17BrO2 |
| InChI | InChI=1S/C10H17BrO2/c1-2-8-5-3-4-6-9(8)13-10(12)7-11/h8-9H,2-7H2,1H3 |
| InChIKey | RAYQKDHUHGGQRP-UHFFFAOYSA-N |
| Molecular Weight | 249.148 g/mol |
| SMILES | C(C(=O)OC1CCCCC1CC)Br |