| SpectraBase Compound ID | 36O7F4n0uQP |
|---|---|
| InChI | InChI=1S/C16H28O4/c1-5-14(6-2)12-20-16(18)9-7-8-15(17)19-11-10-13(3)4/h10,14H,5-9,11-12H2,1-4H3 |
| InChIKey | MGWICACRNOFRQC-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 | AwvhGNttBHI |
|---|---|
| Name | Glutaric acid, 3-methylbut-2-en-1-yl 2-ethylbutyl 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/c1-5-14(6-2)12-20-16(18)9-7-8-15(17)19-11-10-13(3)4/h10,14H,5-9,11-12H2,1-4H3 |
| InChIKey | MGWICACRNOFRQC-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC=C(C)C)=O)C(OCC(CC)CC)=O |