| SpectraBase Compound ID | 1J4pwIqLAeV |
|---|---|
| InChI | InChI=1S/C16H30O4/c1-6-7-8-9-12-19-14(17)10-11-15(18)20-13(2)16(3,4)5/h13H,6-12H2,1-5H3 |
| InChIKey | JMIDGPIHBWDDNE-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 | HWn0To2OuRD |
|---|---|
| Name | Succinic acid, 3,3-dimethylbut-2-yl hexyl 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/c1-6-7-8-9-12-19-14(17)10-11-15(18)20-13(2)16(3,4)5/h13H,6-12H2,1-5H3 |
| InChIKey | JMIDGPIHBWDDNE-UHFFFAOYSA-N |
| SMILES | C(CC(OC(C(C)(C)C)C)=O)C(OCCCCCC)=O |