| SpectraBase Compound ID | FSeUNgSB49l |
|---|---|
| InChI | InChI=1S/C15H17ClO4/c16-11-4-3-7-13(10-11)20-15(18)9-8-14(17)19-12-5-1-2-6-12/h3-4,7,10,12H,1-2,5-6,8-9H2 |
| InChIKey | XWLBYZDZZKSFIW-UHFFFAOYSA-N |
| Mol Weight | 296.75 g/mol |
| Molecular Formula | C15H17ClO4 |
| Exact Mass | 296.081537 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9hKIXGxuSrz |
|---|---|
| Name | Succinic acid, 3-chlorophenyl cyclopentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.081536723 u |
| Formula | C15H17ClO4 |
| InChI | InChI=1S/C15H17ClO4/c16-11-4-3-7-13(10-11)20-15(18)9-8-14(17)19-12-5-1-2-6-12/h3-4,7,10,12H,1-2,5-6,8-9H2 |
| InChIKey | XWLBYZDZZKSFIW-UHFFFAOYSA-N |
| Molecular Weight | 296.750 g/mol |
| SMILES | C(CC(OC1=CC(=CC=C1)Cl)=O)C(OC1CCCC1)=O |