| SpectraBase Compound ID | 6lfCAKKopSl |
|---|---|
| InChI | InChI=1S/C17H30O6/c1-3-5-6-7-10-22-15(18)8-9-16(19)23-13-17(4-2)11-20-14-21-12-17/h3-14H2,1-2H3 |
| InChIKey | ATFYRJWCGHHSCF-UHFFFAOYSA-N |
| Mol Weight | 330.42 g/mol |
| Molecular Formula | C17H30O6 |
| Exact Mass | 330.204239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7auU8hZoB0p |
|---|---|
| Name | Succinic acid, (5-ethyl-1,3-dioxan-5-yl)methyl hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.204238680 u |
| Formula | C17H30O6 |
| InChI | InChI=1S/C17H30O6/c1-3-5-6-7-10-22-15(18)8-9-16(19)23-13-17(4-2)11-20-14-21-12-17/h3-14H2,1-2H3 |
| InChIKey | ATFYRJWCGHHSCF-UHFFFAOYSA-N |
| Molecular Weight | 330.421 g/mol |
| SMILES | C(CCC(OCCCCCC)=O)(=O)OCC1(CC)COCOC1 |