| SpectraBase Compound ID | 2tX2fro0GtD |
|---|---|
| InChI | InChI=1S/C17H30O4/c1-2-3-7-13-20-16(18)10-11-17(19)21-14-12-15-8-5-4-6-9-15/h15H,2-14H2,1H3 |
| InChIKey | QGTSMGULJBUSCF-UHFFFAOYSA-N |
| Mol Weight | 298.42 g/mol |
| Molecular Formula | C17H30O4 |
| Exact Mass | 298.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 725LWtIaxaF |
|---|---|
| Name | Succinic acid, 2-cyclohexylethyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.214409442 u |
| Formula | C17H30O4 |
| InChI | InChI=1S/C17H30O4/c1-2-3-7-13-20-16(18)10-11-17(19)21-14-12-15-8-5-4-6-9-15/h15H,2-14H2,1H3 |
| InChIKey | QGTSMGULJBUSCF-UHFFFAOYSA-N |
| SMILES | CCCCCOC(CCC(OCCC1CCCCC1)=O)=O |