| SpectraBase Compound ID | JuL5zQ9Urcw |
|---|---|
| InChI | InChI=1S/C16H30O4/c1-12(2)10-19-14(17)7-8-15(18)20-11-13(3)9-16(4,5)6/h12-13H,7-11H2,1-6H3 |
| InChIKey | RYRIKSJKBZIUFQ-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 | 52Zuteq7tLc |
|---|---|
| Name | Succinic acid, isobutyl 2,4,4-trimethylpentyl 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/c1-12(2)10-19-14(17)7-8-15(18)20-11-13(3)9-16(4,5)6/h12-13H,7-11H2,1-6H3 |
| InChIKey | RYRIKSJKBZIUFQ-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC(CC(C)(C)C)C)=O)(OCC(C)C)=O |