| SpectraBase Compound ID | Cp3yuMvWUL7 |
|---|---|
| InChI | InChI=1S/C16H30O4/c1-6-8-13(4)11-19-15(17)9-7-10-16(18)20-14(5)12(2)3/h12-14H,6-11H2,1-5H3 |
| InChIKey | BXNBNZPCFWBELA-UHFFFAOYSA-N |
| Mol Weight | 286.41 g/mol |
| Molecular Formula | C16H30O4 |
| Exact Mass | 286.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C1Apvy0atxL |
|---|---|
| Name | Glutaric acid, 3-methylbut-2-yl 2-methylpentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.214409442 u |
| Formula | C16H30O4 |
| InChI | InChI=1S/C16H30O4/c1-6-8-13(4)11-19-15(17)9-7-10-16(18)20-14(5)12(2)3/h12-14H,6-11H2,1-5H3 |
| InChIKey | BXNBNZPCFWBELA-UHFFFAOYSA-N |
| SMILES | C(CCC(OC(C(C)C)C)=O)C(OCC(CCC)C)=O |