| SpectraBase Compound ID | 6cfimL205DW |
|---|---|
| InChI | InChI=1S/C7H11Cl3O3/c1-5(2)3-12-6(11)13-4-7(8,9)10/h5H,3-4H2,1-2H3 |
| InChIKey | NCVLPZBOLRZUAM-UHFFFAOYSA-N |
| Mol Weight | 249.52 g/mol |
| Molecular Formula | C7H11Cl3O3 |
| Exact Mass | 247.977377 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | tHvzEUe1ZO |
|---|---|
| Name | Isobutyl 2,2,2-trichloroethyl carbonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.977377311 u |
| Formula | C7H11Cl3O3 |
| InChI | InChI=1S/C7H11Cl3O3/c1-5(2)3-12-6(11)13-4-7(8,9)10/h5H,3-4H2,1-2H3 |
| InChIKey | NCVLPZBOLRZUAM-UHFFFAOYSA-N |
| Molecular Weight | 249.521 g/mol |
| SMILES | C(OC(=O)OCC(Cl)(Cl)Cl)C(C)C |