| SpectraBase Compound ID | 1GgJHKp92mm |
|---|---|
| InChI | InChI=1S/C17H24O6/c1-4-12-22-15(18)10-5-6-11-16(19)23-17-13(20-2)8-7-9-14(17)21-3/h7-9H,4-6,10-12H2,1-3H3 |
| InChIKey | MPMCEWXBPHNWQZ-UHFFFAOYSA-N |
| Mol Weight | 324.37 g/mol |
| Molecular Formula | C17H24O6 |
| Exact Mass | 324.157288 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IEdEbVcLWEI |
|---|---|
| Name | Adipic acid, 2,6-dimethoxyphenyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.157288487 u |
| Formula | C17H24O6 |
| InChI | InChI=1S/C17H24O6/c1-4-12-22-15(18)10-5-6-11-16(19)23-17-13(20-2)8-7-9-14(17)21-3/h7-9H,4-6,10-12H2,1-3H3 |
| InChIKey | MPMCEWXBPHNWQZ-UHFFFAOYSA-N |
| Molecular Weight | 324.373 g/mol |
| SMILES | C(CCCCC(=O)OC1=C(OC)C=CC=C1OC)(OCCC)=O |