| SpectraBase Compound ID | 5Kt7d9xX3j6 |
|---|---|
| InChI | InChI=1S/C16H30O4/c1-3-5-6-7-8-11-14-20-16(18)13-10-9-12-15(17)19-4-2/h3-14H2,1-2H3 |
| InChIKey | LJFLUCWGAKXPJW-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 | 3ZYNRDg1PPz |
|---|---|
| Name | Adipic acid, ethyl octyl 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/c1-3-5-6-7-8-11-14-20-16(18)13-10-9-12-15(17)19-4-2/h3-14H2,1-2H3 |
| InChIKey | LJFLUCWGAKXPJW-UHFFFAOYSA-N |
| SMILES | C(C(=O)OCCCCCCCC)CCCC(OCC)=O |