| SpectraBase Compound ID | 2eUMhoJP3PU |
|---|---|
| InChI | InChI=1S/C19H26Cl2O4/c1-2-3-4-5-12-24-18(22)7-6-8-19(23)25-13-11-15-9-10-16(20)14-17(15)21/h9-10,14H,2-8,11-13H2,1H3 |
| InChIKey | VBEDXHFRGYMWMV-UHFFFAOYSA-N |
| Mol Weight | 389.32 g/mol |
| Molecular Formula | C19H26Cl2O4 |
| Exact Mass | 388.120815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CDsfNcLywcl |
|---|---|
| Name | Glutaric acid, 2-(2,4-dichlorophenyl)ethyl hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 388.120814713 u |
| Formula | C19H26Cl2O4 |
| InChI | InChI=1S/C19H26Cl2O4/c1-2-3-4-5-12-24-18(22)7-6-8-19(23)25-13-11-15-9-10-16(20)14-17(15)21/h9-10,14H,2-8,11-13H2,1H3 |
| InChIKey | VBEDXHFRGYMWMV-UHFFFAOYSA-N |
| Molecular Weight | 389.319 g/mol |
| SMILES | C(OCCC1=CC=C(C=C1Cl)Cl)(=O)CCCC(OCCCCCC)=O |