| SpectraBase Compound ID | IXzqi1QUxY0 |
|---|---|
| InChI | InChI=1S/C15H26O4/c1-12(2)6-5-10-18-14(16)7-8-15(17)19-11-9-13(3)4/h12H,3,5-11H2,1-2,4H3 |
| InChIKey | FJDWQINGJCTZAW-UHFFFAOYSA-N |
| Mol Weight | 270.37 g/mol |
| Molecular Formula | C15H26O4 |
| Exact Mass | 270.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4zNkzFyvkA1 |
|---|---|
| Name | Succinic acid, isohexyl 3-methylbut-3-enyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.183109313 u |
| Formula | C15H26O4 |
| InChI | InChI=1S/C15H26O4/c1-12(2)6-5-10-18-14(16)7-8-15(17)19-11-9-13(3)4/h12H,3,5-11H2,1-2,4H3 |
| InChIKey | FJDWQINGJCTZAW-UHFFFAOYSA-N |
| Molecular Weight | 270.369 g/mol |
| SMILES | CC(=C)CCOC(CCC(OCCCC(C)C)=O)=O |