| SpectraBase Compound ID | I5cWZ4lTvBL |
|---|---|
| InChI | InChI=1S/C16H27Cl3O4/c1-2-3-4-5-6-7-8-9-12-22-14(20)10-11-15(21)23-13-16(17,18)19/h2-13H2,1H3 |
| InChIKey | FAIYXLQCQHTADH-UHFFFAOYSA-N |
| Mol Weight | 389.75 g/mol |
| Molecular Formula | C16H27Cl3O4 |
| Exact Mass | 388.097492 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BBp2wIdiU9y |
|---|---|
| Name | Succinic acid, decyl 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 388.097492445 u |
| Formula | C16H27Cl3O4 |
| InChI | InChI=1S/C16H27Cl3O4/c1-2-3-4-5-6-7-8-9-12-22-14(20)10-11-15(21)23-13-16(17,18)19/h2-13H2,1H3 |
| InChIKey | FAIYXLQCQHTADH-UHFFFAOYSA-N |
| Molecular Weight | 389.747 g/mol |
| SMILES | C(CCC(OCC(Cl)(Cl)Cl)=O)(OCCCCCCCCCC)=O |