| SpectraBase Compound ID | nOJpgV4FvG |
|---|---|
| InChI | InChI=1S/C17H24O5/c1-3-4-13-21-16(18)7-5-6-8-17(19)22-15-11-9-14(20-2)10-12-15/h9-12H,3-8,13H2,1-2H3 |
| InChIKey | REDIJXXWKCVKCC-UHFFFAOYSA-N |
| Mol Weight | 308.37 g/mol |
| Molecular Formula | C17H24O5 |
| Exact Mass | 308.162374 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 29Vxrz4JEis |
|---|---|
| Name | Adipic acid, butyl 4-methoxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.162373868 u |
| Formula | C17H24O5 |
| InChI | InChI=1S/C17H24O5/c1-3-4-13-21-16(18)7-5-6-8-17(19)22-15-11-9-14(20-2)10-12-15/h9-12H,3-8,13H2,1-2H3 |
| InChIKey | REDIJXXWKCVKCC-UHFFFAOYSA-N |
| SMILES | C(OC(CCCCC(=O)OC1=CC=C(OC)C=C1)=O)CCC |