| SpectraBase Compound ID | AYIPz7y2xSd |
|---|---|
| InChI | InChI=1S/C11H11Cl3O3/c1-7-3-8(2)5-9(4-7)17-10(15)16-6-11(12,13)14/h3-5H,6H2,1-2H3 |
| InChIKey | FULSZXNBYPXZFY-UHFFFAOYSA-N |
| Mol Weight | 297.57 g/mol |
| Molecular Formula | C11H11Cl3O3 |
| Exact Mass | 295.977377 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KvocUDvn3uw |
|---|---|
| Name | Carbonic acid, 2,2,2-trichloroethyl 3,5-dimethylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.977377311 u |
| Formula | C11H11Cl3O3 |
| InChI | InChI=1S/C11H11Cl3O3/c1-7-3-8(2)5-9(4-7)17-10(15)16-6-11(12,13)14/h3-5H,6H2,1-2H3 |
| InChIKey | FULSZXNBYPXZFY-UHFFFAOYSA-N |
| Molecular Weight | 297.565 g/mol |
| SMILES | CC1=CC(C)=CC(=C1)OC(OCC(Cl)(Cl)Cl)=O |