| SpectraBase Compound ID | 8xUKaDqea4K |
|---|---|
| InChI | InChI=1S/C4H4BrCl3O2/c5-1-3(9)10-2-4(6,7)8/h1-2H2 |
| InChIKey | GEYYLJCQSBTPQO-UHFFFAOYSA-N |
| Mol Weight | 270.34 g/mol |
| Molecular Formula | C4H4BrCl3O2 |
| Exact Mass | 267.846025 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2UggYcgulIM |
|---|---|
| Name | Acetate, 2-bromo-,2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.846025467 u |
| Formula | C4H4BrCl3O2 |
| InChI | InChI=1S/C4H4BrCl3O2/c5-1-3(9)10-2-4(6,7)8/h1-2H2 |
| InChIKey | GEYYLJCQSBTPQO-UHFFFAOYSA-N |
| SMILES | C(=O)(CBr)OCC(Cl)(Cl)Cl |