| SpectraBase Compound ID | DruZURhcUMa |
|---|---|
| InChI | InChI=1S/C11H9Cl3O2/c1-6(2)3-11(15)16-10-5-8(13)7(12)4-9(10)14/h3-5H,1-2H3 |
| InChIKey | RIWFJYJVQGPRGX-UHFFFAOYSA-N |
| Mol Weight | 279.55 g/mol |
| Molecular Formula | C11H9Cl3O2 |
| Exact Mass | 277.966813 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1gzTZgBTZi4 |
|---|---|
| Name | 3-Methylbut-2-enoic acid, 2,4,5-trichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.966812628 u |
| Formula | C11H9Cl3O2 |
| InChI | InChI=1S/C11H9Cl3O2/c1-6(2)3-11(15)16-10-5-8(13)7(12)4-9(10)14/h3-5H,1-2H3 |
| InChIKey | RIWFJYJVQGPRGX-UHFFFAOYSA-N |
| SMILES | C(C=C(C)C)(=O)OC1=C(C=C(C(=C1)Cl)Cl)Cl |