| SpectraBase Compound ID | JmMaFHW6Wh3 |
|---|---|
| InChI | InChI=1S/C24H46O5/c1-6-9-10-11-12-13-14-15-18-28-22(25)24(7-2,8-3)23(26)29-20-17-21(4)16-19-27-5/h21H,6-20H2,1-5H3 |
| InChIKey | RLUNFFOOYRYVCP-UHFFFAOYSA-N |
| Mol Weight | 414.6 g/mol |
| Molecular Formula | C24H46O5 |
| Exact Mass | 414.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J42EX0rjfZH |
|---|---|
| Name | Diethylmalonic acid, decyl 5-methoxy-3-methylpentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 414.334524576 u |
| Formula | C24H46O5 |
| InChI | InChI=1S/C24H46O5/c1-6-9-10-11-12-13-14-15-18-28-22(25)24(7-2,8-3)23(26)29-20-17-21(4)16-19-27-5/h21H,6-20H2,1-5H3 |
| InChIKey | RLUNFFOOYRYVCP-UHFFFAOYSA-N |
| Molecular Weight | 414.627 g/mol |
| SMILES | C(C(C(OCCCCCCCCCC)=O)(CC)CC)(OCCC(CCOC)C)=O |