| SpectraBase Compound ID | KyQT8n0sULR |
|---|---|
| InChI | InChI=1S/C23H42Cl2O4/c24-17-13-9-5-1-3-7-11-15-19-28-22(26)21-23(27)29-20-16-12-8-4-2-6-10-14-18-25/h1-21H2 |
| InChIKey | PSRUFBQUTBXALV-UHFFFAOYSA-N |
| Mol Weight | 453.5 g/mol |
| Molecular Formula | C23H42Cl2O4 |
| Exact Mass | 452.246015 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6cH744XXYtG |
|---|---|
| Name | Malonic acid, di(10-chlorodecyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 452.246015228 u |
| Formula | C23H42Cl2O4 |
| InChI | InChI=1S/C23H42Cl2O4/c24-17-13-9-5-1-3-7-11-15-19-28-22(26)21-23(27)29-20-16-12-8-4-2-6-10-14-18-25/h1-21H2 |
| InChIKey | PSRUFBQUTBXALV-UHFFFAOYSA-N |
| Molecular Weight | 453.491 g/mol |
| SMILES | C(C(OCCCCCCCCCCCl)=O)C(OCCCCCCCCCCCl)=O |