| SpectraBase Compound ID | 4maxP1r4DEy |
|---|---|
| InChI | InChI=1S/C17H24O5/c1-4-5-12-20-16(18)10-11-17(19)22-15-9-7-6-8-14(15)21-13(2)3/h6-9,13H,4-5,10-12H2,1-3H3 |
| InChIKey | ZIQUIGYDLQMGNT-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 | FieCxPxyLIf |
|---|---|
| Name | Succinic acid, butyl 2-isopropoxyphenyl 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/c1-4-5-12-20-16(18)10-11-17(19)22-15-9-7-6-8-14(15)21-13(2)3/h6-9,13H,4-5,10-12H2,1-3H3 |
| InChIKey | ZIQUIGYDLQMGNT-UHFFFAOYSA-N |
| SMILES | C1=CC(=C(C=C1)OC(C)C)OC(=O)CCC(OCCCC)=O |