| SpectraBase Compound ID | K1J3fPbh7HK |
|---|---|
| InChI | InChI=1S/C15H26O6/c1-4-15(8-18-11-19-9-15)10-21-14(17)6-5-13(16)20-7-12(2)3/h12H,4-11H2,1-3H3 |
| InChIKey | LMOZJKVBOJUQKO-UHFFFAOYSA-N |
| Mol Weight | 302.37 g/mol |
| Molecular Formula | C15H26O6 |
| Exact Mass | 302.172939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 813tLkfuMqK |
|---|---|
| Name | Succinic acid, (5-ethyl-1,3-dioxan-5-yl)methyl isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.172938551 u |
| Formula | C15H26O6 |
| InChI | InChI=1S/C15H26O6/c1-4-15(8-18-11-19-9-15)10-21-14(17)6-5-13(16)20-7-12(2)3/h12H,4-11H2,1-3H3 |
| InChIKey | LMOZJKVBOJUQKO-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC(C)C)=O)(=O)OCC1(CC)COCOC1 |