| SpectraBase Compound ID | 9qX8tZ6GbQQ |
|---|---|
| InChI | InChI=1S/C20H37ClO4/c1-2-3-17-24-19(22)14-10-11-15-20(23)25-18-13-9-7-5-4-6-8-12-16-21/h2-18H2,1H3 |
| InChIKey | ZHDPBMMHKUYQOC-UHFFFAOYSA-N |
| Mol Weight | 377.0 g/mol |
| Molecular Formula | C20H37ClO4 |
| Exact Mass | 376.238037 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ApQLVSxQddV |
|---|---|
| Name | Adipic acid, butyl 10-chlorodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 376.238037367 u |
| Formula | C20H37ClO4 |
| InChI | InChI=1S/C20H37ClO4/c1-2-3-17-24-19(22)14-10-11-15-20(23)25-18-13-9-7-5-4-6-8-12-16-21/h2-18H2,1H3 |
| InChIKey | ZHDPBMMHKUYQOC-UHFFFAOYSA-N |
| Molecular Weight | 376.965 g/mol |
| SMILES | C(OCCCCCCCCCCCl)(CCCCC(OCCCC)=O)=O |