| SpectraBase Compound ID | 7UXHFADQlE7 |
|---|---|
| InChI | InChI=1S/C20H28Cl2O4/c1-2-3-4-5-6-7-8-15-25-18(23)13-10-14-19(24)26-20-16(21)11-9-12-17(20)22/h9,11-12H,2-8,10,13-15H2,1H3 |
| InChIKey | QLKLATHODKJSNN-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 | HqtYcctJH2f |
|---|---|
| Name | Glutaric acid, 2,6-dichlorophenyl nonyl 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/c1-2-3-4-5-6-7-8-15-25-18(23)13-10-14-19(24)26-20-16(21)11-9-12-17(20)22/h9,11-12H,2-8,10,13-15H2,1H3 |
| InChIKey | QLKLATHODKJSNN-UHFFFAOYSA-N |
| Molecular Weight | 403.346 g/mol |
| SMILES | CCCCCCCCCOC(CCCC(OC1=C(C=CC=C1Cl)Cl)=O)=O |