| SpectraBase Compound ID | Bu5esS5MaFu |
|---|---|
| InChI | InChI=1S/C17H24O4/c1-3-4-7-12-20-16(18)10-11-17(19)21-13-15-9-6-5-8-14(15)2/h5-6,8-9H,3-4,7,10-13H2,1-2H3 |
| InChIKey | UOLMWVQLOGLBTA-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 | 5rH1qTiOljw |
|---|---|
| Name | Succinic acid, 2-methylbenzyl pentyl 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/c1-3-4-7-12-20-16(18)10-11-17(19)21-13-15-9-6-5-8-14(15)2/h5-6,8-9H,3-4,7,10-13H2,1-2H3 |
| InChIKey | UOLMWVQLOGLBTA-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC=1C(C)=CC=CC1)=O)(OCCCCC)=O |