| SpectraBase Compound ID | 1Wc8JbNbapl |
|---|---|
| InChI | InChI=1S/C17H30O4/c1-2-13-20-16(18)10-6-7-11-17(19)21-14-12-15-8-4-3-5-9-15/h15H,2-14H2,1H3 |
| InChIKey | AEBGNCLJZCVBHV-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 | 8RqHstGIV8J |
|---|---|
| Name | Adipic acid, 2-cyclohexylethyl propyl 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/c1-2-13-20-16(18)10-6-7-11-17(19)21-14-12-15-8-4-3-5-9-15/h15H,2-14H2,1H3 |
| InChIKey | AEBGNCLJZCVBHV-UHFFFAOYSA-N |
| SMILES | C(CCC(=O)OCCC1CCCCC1)CC(OCCC)=O |