| SpectraBase Compound ID | EL8nJaH5qd |
|---|---|
| InChI | InChI=1S/C20H28Cl2O4/c1-3-4-5-6-7-8-9-15(2)25-19(23)10-11-20(24)26-18-13-16(21)12-17(22)14-18/h12-15H,3-11H2,1-2H3 |
| InChIKey | XHMFVOPEJDMACN-UHFFFAOYSA-N |
| Mol Weight | 403.35 g/mol |
| Molecular Formula | C20H28Cl2O4 |
| Exact Mass | 402.136465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | clAEsr45Tl |
|---|---|
| Name | Succinic acid, dec-2-yl 3,5-dichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 402.136464778 u |
| Formula | C20H28Cl2O4 |
| InChI | InChI=1S/C20H28Cl2O4/c1-3-4-5-6-7-8-9-15(2)25-19(23)10-11-20(24)26-18-13-16(21)12-17(22)14-18/h12-15H,3-11H2,1-2H3 |
| InChIKey | XHMFVOPEJDMACN-UHFFFAOYSA-N |
| Molecular Weight | 403.346 g/mol |
| SMILES | C(CC(OC(C)CCCCCCCC)=O)C(OC1=CC(=CC(=C1)Cl)Cl)=O |