| SpectraBase Compound ID | BkBoF3UcUWX |
|---|---|
| InChI | InChI=1S/C10H17Cl3O3/c1-2-3-4-5-6-7-15-9(14)16-8-10(11,12)13/h2-8H2,1H3 |
| InChIKey | WQZYEBRQWANQEC-UHFFFAOYSA-N |
| Mol Weight | 291.6 g/mol |
| Molecular Formula | C10H17Cl3O3 |
| Exact Mass | 290.024328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9FMcTTWfo8Y |
|---|---|
| Name | Carbonic acid, heptyl 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.024327504 u |
| Formula | C10H17Cl3O3 |
| InChI | InChI=1S/C10H17Cl3O3/c1-2-3-4-5-6-7-15-9(14)16-8-10(11,12)13/h2-8H2,1H3 |
| InChIKey | WQZYEBRQWANQEC-UHFFFAOYSA-N |
| Molecular Weight | 291.602 g/mol |
| SMILES | C(OCCCCCCC)(=O)OCC(Cl)(Cl)Cl |