| SpectraBase Compound ID | LyHYlWrdiiM |
|---|---|
| InChI | InChI=1S/C30H58O4/c1-5-9-11-13-15-17-19-21-23-25-27-34-29(32)30(7-3,8-4)28(31)33-26-24-22-20-18-16-14-12-10-6-2/h5-27H2,1-4H3 |
| InChIKey | MDXPFHRRQOLCHT-UHFFFAOYSA-N |
| Mol Weight | 482.8 g/mol |
| Molecular Formula | C30H58O4 |
| Exact Mass | 482.43351 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | gb2c6qjumq |
|---|---|
| Name | Diethylmalonic acid, dodecyl undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 482.433510344 u |
| Formula | C30H58O4 |
| InChI | InChI=1S/C30H58O4/c1-5-9-11-13-15-17-19-21-23-25-27-34-29(32)30(7-3,8-4)28(31)33-26-24-22-20-18-16-14-12-10-6-2/h5-27H2,1-4H3 |
| InChIKey | MDXPFHRRQOLCHT-UHFFFAOYSA-N |
| Molecular Weight | 482.790 g/mol |
| SMILES | CCC(C(OCCCCCCCCCCC)=O)(C(OCCCCCCCCCCCC)=O)CC |