| SpectraBase Compound ID | 6nLfN7TLf4P |
|---|---|
| InChI | InChI=1S/C13H15ClO4/c1-2-17-12(15)6-7-13(16)18-9-10-4-3-5-11(14)8-10/h3-5,8H,2,6-7,9H2,1H3 |
| InChIKey | CLWGWBXPCUWFGP-UHFFFAOYSA-N |
| Mol Weight | 270.71 g/mol |
| Molecular Formula | C13H15ClO4 |
| Exact Mass | 270.065887 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7GItAi8aCnc |
|---|---|
| Name | Succinic acid, 3-chlorobenzyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.065886659 u |
| Formula | C13H15ClO4 |
| InChI | InChI=1S/C13H15ClO4/c1-2-17-12(15)6-7-13(16)18-9-10-4-3-5-11(14)8-10/h3-5,8H,2,6-7,9H2,1H3 |
| InChIKey | CLWGWBXPCUWFGP-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC1=CC(=CC=C1)Cl)=O)(OCC)=O |