| SpectraBase Compound ID | 3mEqcoLLYrV |
|---|---|
| InChI | InChI=1S/C11H12Cl2O2/c1-11(2,3)10(14)15-7-4-5-8(12)9(13)6-7/h4-6H,1-3H3 |
| InChIKey | XIRSVOKAKYHVOX-UHFFFAOYSA-N |
| Mol Weight | 247.12 g/mol |
| Molecular Formula | C11H12Cl2O2 |
| Exact Mass | 246.021435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DhxwqVSNpJF |
|---|---|
| Name | 2,2-Dimethylpropanoic acid, 3,4-dichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.021435024 u |
| Formula | C11H12Cl2O2 |
| InChI | InChI=1S/C11H12Cl2O2/c1-11(2,3)10(14)15-7-4-5-8(12)9(13)6-7/h4-6H,1-3H3 |
| InChIKey | XIRSVOKAKYHVOX-UHFFFAOYSA-N |
| Molecular Weight | 247.121 g/mol |
| SMILES | CC(C(=O)OC1=CC(=C(C=C1)Cl)Cl)(C)C |