| SpectraBase Compound ID | 1X0nULCM1qM |
|---|---|
| InChI | InChI=1S/C18H32O6/c1-5-7-15(14(3)4)24-17(20)9-8-16(19)23-12-18(6-2)10-21-13-22-11-18/h14-15H,5-13H2,1-4H3 |
| InChIKey | JEUATORRIVATDY-UHFFFAOYSA-N |
| Mol Weight | 344.4 g/mol |
| Molecular Formula | C18H32O6 |
| Exact Mass | 344.219889 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E8vTFaSOBYz |
|---|---|
| Name | Succinic acid, (5-ethyl-1,3-dioxan-5-yl)methyl 2-methylhex-3-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 344.219888744 u |
| Formula | C18H32O6 |
| InChI | InChI=1S/C18H32O6/c1-5-7-15(14(3)4)24-17(20)9-8-16(19)23-12-18(6-2)10-21-13-22-11-18/h14-15H,5-13H2,1-4H3 |
| InChIKey | JEUATORRIVATDY-UHFFFAOYSA-N |
| Molecular Weight | 344.448 g/mol |
| SMILES | C(CCC(OC(CCC)C(C)C)=O)(=O)OCC1(CC)COCOC1 |