| SpectraBase Compound ID | DW9pDansphn |
|---|---|
| InChI | InChI=1S/C17H30O4/c1-12(2)10-11-20-15(18)8-7-9-16(19)21-17(13(3)4)14(5)6/h10,13-14,17H,7-9,11H2,1-6H3 |
| InChIKey | VUHSGQPPQFIUPZ-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 | oDXHG3jakB |
|---|---|
| Name | Glutaric acid, 3-methylbut-2-en-1-yl 2,4-dimethylpent-3-yl 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/c1-12(2)10-11-20-15(18)8-7-9-16(19)21-17(13(3)4)14(5)6/h10,13-14,17H,7-9,11H2,1-6H3 |
| InChIKey | VUHSGQPPQFIUPZ-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC=C(C)C)=O)C(OC(C(C)C)C(C)C)=O |