| SpectraBase Compound ID | 2ffDU2V0Rzt |
|---|---|
| InChI | InChI=1S/C17H24O4/c1-3-9-14-10-5-6-11-15(14)21-17(19)13-8-7-12-16(18)20-4-2/h5-6,10-11H,3-4,7-9,12-13H2,1-2H3 |
| InChIKey | PVHUSFVCWXXJMT-UHFFFAOYSA-N |
| Mol Weight | 292.38 g/mol |
| Molecular Formula | C17H24O4 |
| Exact Mass | 292.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4oIRuFc2Jmr |
|---|---|
| Name | Adipic acid, ethyl 2-propylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.167459249 u |
| Formula | C17H24O4 |
| InChI | InChI=1S/C17H24O4/c1-3-9-14-10-5-6-11-15(14)21-17(19)13-8-7-12-16(18)20-4-2/h5-6,10-11H,3-4,7-9,12-13H2,1-2H3 |
| InChIKey | PVHUSFVCWXXJMT-UHFFFAOYSA-N |
| SMILES | C(CCCC(OC=1C(CCC)=CC=CC1)=O)C(OCC)=O |