| SpectraBase Compound ID | 6q2yADSvQYF |
|---|---|
| InChI | InChI=1S/C17H30O4/c1-2-3-9-14-20-16(18)12-7-8-13-17(19)21-15-10-5-4-6-11-15/h15H,2-14H2,1H3 |
| InChIKey | QKWWPEXWZPYPNH-UHFFFAOYSA-N |
| Mol Weight | 298.42 g/mol |
| Molecular Formula | C17H30O4 |
| Exact Mass | 298.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4hUsGEB7LpF |
|---|---|
| Name | Adipic acid, cyclohexyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.214409442 u |
| Formula | C17H30O4 |
| InChI | InChI=1S/C17H30O4/c1-2-3-9-14-20-16(18)12-7-8-13-17(19)21-15-10-5-4-6-11-15/h15H,2-14H2,1H3 |
| InChIKey | QKWWPEXWZPYPNH-UHFFFAOYSA-N |
| SMILES | C(CCCC(=O)OC1CCCCC1)C(OCCCCC)=O |