| SpectraBase Compound ID | IW8E9GIqzCQ |
|---|---|
| InChI | InChI=1S/C9H7BrCl2O2/c1-5(10)9(13)14-6-2-3-7(11)8(12)4-6/h2-5H,1H3 |
| InChIKey | HOKTYFOLCUZQDD-UHFFFAOYSA-N |
| Mol Weight | 297.96 g/mol |
| Molecular Formula | C9H7BrCl2O2 |
| Exact Mass | 295.900648 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | eXZkZEkKEb |
|---|---|
| Name | 2-Bromopropionic acid, 3,4-dichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.900647863 u |
| Formula | C9H7BrCl2O2 |
| InChI | InChI=1S/C9H7BrCl2O2/c1-5(10)9(13)14-6-2-3-7(11)8(12)4-6/h2-5H,1H3 |
| InChIKey | HOKTYFOLCUZQDD-UHFFFAOYSA-N |
| SMILES | C(C(=O)OC1=CC=C(C(=C1)Cl)Cl)(Br)C |