| SpectraBase Compound ID | KaYmYtXNpd8 |
|---|---|
| InChI | InChI=1S/C23H44O5/c1-5-8-9-10-11-12-13-14-15-16-17-18-27-21(24)23(6-2,7-3)22(25)28-20-19-26-4/h5-20H2,1-4H3 |
| InChIKey | GHLKLXHWTJTUAY-UHFFFAOYSA-N |
| Mol Weight | 400.6 g/mol |
| Molecular Formula | C23H44O5 |
| Exact Mass | 400.318875 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LNXMCGCrF4o |
|---|---|
| Name | Diethylmalonic acid, 2-methoxyethyl tridecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 400.318874512 u |
| Formula | C23H44O5 |
| InChI | InChI=1S/C23H44O5/c1-5-8-9-10-11-12-13-14-15-16-17-18-27-21(24)23(6-2,7-3)22(25)28-20-19-26-4/h5-20H2,1-4H3 |
| InChIKey | GHLKLXHWTJTUAY-UHFFFAOYSA-N |
| Molecular Weight | 400.600 g/mol |
| SMILES | C(C(C(OCCCCCCCCCCCCC)=O)(CC)CC)(OCCOC)=O |