| SpectraBase Compound ID | AVwsQJfsJn3 |
|---|---|
| InChI | InChI=1S/C19H36O4/c1-8-16(14(2)3)23-18(21)11-9-10-17(20)22-13-15(4)12-19(5,6)7/h14-16H,8-13H2,1-7H3 |
| InChIKey | ILRWHECZETUXMO-UHFFFAOYSA-N |
| Mol Weight | 328.5 g/mol |
| Molecular Formula | C19H36O4 |
| Exact Mass | 328.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 21Rwnrlguqt |
|---|---|
| Name | Glutaric acid, 2-methylpent-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 | 328.261359635 u |
| Formula | C19H36O4 |
| InChI | InChI=1S/C19H36O4/c1-8-16(14(2)3)23-18(21)11-9-10-17(20)22-13-15(4)12-19(5,6)7/h14-16H,8-13H2,1-7H3 |
| InChIKey | ILRWHECZETUXMO-UHFFFAOYSA-N |
| Molecular Weight | 328.493 g/mol |
| SMILES | C(CCC(OC(CC)C(C)C)=O)C(OCC(CC(C)(C)C)C)=O |