SpectraBase Compound ID | 7qcTsvPnJzg |
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InChI | InChI=1S/C14H16Cl2O4/c1-2-8-19-12(17)6-7-13(18)20-9-10-4-3-5-11(15)14(10)16/h3-5H,2,6-9H2,1H3 |
InChIKey | BSFODSQJHBLKEO-UHFFFAOYSA-N |
Mol Weight | 319.18 g/mol |
Molecular Formula | C14H16Cl2O4 |
Exact Mass | 318.042564 g/mol |
SpectraBase Spectrum ID | HaWSSnlQtKl |
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Name | Succinic acid, 2,3-dichlorobenzyl propyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 318.042564391 u |
Formula | C14H16Cl2O4 |
InChI | InChI=1S/C14H16Cl2O4/c1-2-8-19-12(17)6-7-13(18)20-9-10-4-3-5-11(15)14(10)16/h3-5H,2,6-9H2,1H3 |
InChIKey | BSFODSQJHBLKEO-UHFFFAOYSA-N |
Molecular Weight | 319.184 g/mol |
SMILES | C1=CC=C(C(=C1Cl)Cl)COC(=O)CCC(OCCC)=O |