| SpectraBase Compound ID | 82JBqALAKVO |
|---|---|
| InChI | InChI=1S/C16H28O4/c1-12(2)9-10-19-15(17)7-6-8-16(18)20-14(5)11-13(3)4/h9,13-14H,6-8,10-11H2,1-5H3 |
| InChIKey | HGXKVKFNAFHIST-UHFFFAOYSA-N |
| Mol Weight | 284.4 g/mol |
| Molecular Formula | C16H28O4 |
| Exact Mass | 284.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 10CUMpGUylQ |
|---|---|
| Name | Glutaric acid, 3-methylbut-2-en-1-yl 4-methylpent-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.198759378 u |
| Formula | C16H28O4 |
| InChI | InChI=1S/C16H28O4/c1-12(2)9-10-19-15(17)7-6-8-16(18)20-14(5)11-13(3)4/h9,13-14H,6-8,10-11H2,1-5H3 |
| InChIKey | HGXKVKFNAFHIST-UHFFFAOYSA-N |
| SMILES | C(CCC(OC(C)CC(C)C)=O)C(OCC=C(C)C)=O |