| SpectraBase Compound ID | FS7yBQcKhSJ |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-3-9-18-14(16)7-8-15(17)19-11-13-6-4-5-12(2)10-13/h4-6,10H,3,7-9,11H2,1-2H3 |
| InChIKey | PPQBZHCNLSORKS-UHFFFAOYSA-N |
| Mol Weight | 264.32 g/mol |
| Molecular Formula | C15H20O4 |
| Exact Mass | 264.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E20L633ihmJ |
|---|---|
| Name | Succinic acid, 3-methylbenzyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.136159120 u |
| Formula | C15H20O4 |
| InChI | InChI=1S/C15H20O4/c1-3-9-18-14(16)7-8-15(17)19-11-13-6-4-5-12(2)10-13/h4-6,10H,3,7-9,11H2,1-2H3 |
| InChIKey | PPQBZHCNLSORKS-UHFFFAOYSA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | C(OC(=O)CCC(OCCC)=O)C=1C=CC=C(C)C1 |