SpectraBase Compound ID | 7zkBNi34dkL |
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InChI | InChI=1S/C19H18Cl2O4/c20-15-8-4-9-16(19(15)21)25-18(23)11-5-10-17(22)24-13-12-14-6-2-1-3-7-14/h1-4,6-9H,5,10-13H2 |
InChIKey | NKCUMQKHGOXIBQ-UHFFFAOYSA-N |
Mol Weight | 381.26 g/mol |
Molecular Formula | C19H18Cl2O4 |
Exact Mass | 380.058214 g/mol |
SpectraBase Spectrum ID | 4PvC9ZS9b2I |
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Name | Glutaric acid, 2,3-dichlorophenyl phenethyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 380.058214456 u |
Formula | C19H18Cl2O4 |
InChI | InChI=1S/C19H18Cl2O4/c20-15-8-4-9-16(19(15)21)25-18(23)11-5-10-17(22)24-13-12-14-6-2-1-3-7-14/h1-4,6-9H,5,10-13H2 |
InChIKey | NKCUMQKHGOXIBQ-UHFFFAOYSA-N |
Molecular Weight | 381.255 g/mol |
SMILES | C(CCC(OC1=C(C(=CC=C1)Cl)Cl)=O)C(OCCC1=CC=CC=C1)=O |