| SpectraBase Compound ID | GviAWrmI8Ii |
|---|---|
| InChI | InChI=1S/C20H38O4/c1-8-10-17(15(2)3)24-19(22)12-9-11-18(21)23-14-16(4)13-20(5,6)7/h15-17H,8-14H2,1-7H3 |
| InChIKey | UGESDFFYQZYVRC-UHFFFAOYSA-N |
| Mol Weight | 342.5 g/mol |
| Molecular Formula | C20H38O4 |
| Exact Mass | 342.27701 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E0cDXjwk0vw |
|---|---|
| Name | Glutaric acid, 2-methylhex-3-yl 2,4,4-trimethylpentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.277009700 u |
| Formula | C20H38O4 |
| InChI | InChI=1S/C20H38O4/c1-8-10-17(15(2)3)24-19(22)12-9-11-18(21)23-14-16(4)13-20(5,6)7/h15-17H,8-14H2,1-7H3 |
| InChIKey | UGESDFFYQZYVRC-UHFFFAOYSA-N |
| Molecular Weight | 342.520 g/mol |
| SMILES | C(OCC(CC(C)(C)C)C)(=O)CCCC(OC(CCC)C(C)C)=O |