| SpectraBase Compound ID | AxVfCZtesxD |
|---|---|
| InChI | InChI=1S/C17H30O4/c1-3-8-14(2)21-17(19)12-7-11-16(18)20-13-15-9-5-4-6-10-15/h14-15H,3-13H2,1-2H3 |
| InChIKey | UKHCSIWFOWTBIS-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 | 9i8buIUhfVk |
|---|---|
| Name | Glutaric acid, cyclohexylmethyl 2-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/c1-3-8-14(2)21-17(19)12-7-11-16(18)20-13-15-9-5-4-6-10-15/h14-15H,3-13H2,1-2H3 |
| InChIKey | UKHCSIWFOWTBIS-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC1CCCCC1)=O)C(OC(C)CCC)=O |