| SpectraBase Compound ID | Khzq88xE5Y1 |
|---|---|
| InChI | InChI=1S/C18H30O4/c1-15(2)11-13-21-17(19)9-6-10-18(20)22-14-12-16-7-4-3-5-8-16/h11,16H,3-10,12-14H2,1-2H3 |
| InChIKey | VCZYIPXQPKZSJS-UHFFFAOYSA-N |
| Mol Weight | 310.43 g/mol |
| Molecular Formula | C18H30O4 |
| Exact Mass | 310.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L01vnBPkPVU |
|---|---|
| Name | Glutaric acid, 2-(cyclohexyl)ethyl 3-methylbut-2-en-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.214409442 u |
| Formula | C18H30O4 |
| InChI | InChI=1S/C18H30O4/c1-15(2)11-13-21-17(19)9-6-10-18(20)22-14-12-16-7-4-3-5-8-16/h11,16H,3-10,12-14H2,1-2H3 |
| InChIKey | VCZYIPXQPKZSJS-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC=C(C)C)=O)C(OCCC1CCCCC1)=O |