| SpectraBase Compound ID | HRelz4c6NZE |
|---|---|
| InChI | InChI=1S/C23H44O4/c1-7-13-15-19(9-3)17-26-21(24)23(11-5,12-6)22(25)27-18-20(10-4)16-14-8-2/h19-20H,7-18H2,1-6H3 |
| InChIKey | YODPTQXQCQWQTN-UHFFFAOYSA-N |
| Mol Weight | 384.6 g/mol |
| Molecular Formula | C23H44O4 |
| Exact Mass | 384.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DNMkj3qpNKV |
|---|---|
| Name | Diethylmalonic acid, di(2-ethylhexyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 384.323959893 u |
| Formula | C23H44O4 |
| InChI | InChI=1S/C23H44O4/c1-7-13-15-19(9-3)17-26-21(24)23(11-5,12-6)22(25)27-18-20(10-4)16-14-8-2/h19-20H,7-18H2,1-6H3 |
| InChIKey | YODPTQXQCQWQTN-UHFFFAOYSA-N |
| Molecular Weight | 384.601 g/mol |
| SMILES | CCC(C(OCC(CC)CCCC)=O)(C(OCC(CC)CCCC)=O)CC |