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Glutaric acid, 2,2-dichloroethyl 3-phenoxybenzyl ester

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Glutaric acid, 2,2-dichloroethyl 3-phenoxybenzyl ester
SpectraBase Compound ID Fy2STiloFWa
InChI InChI=1S/C20H20Cl2O5/c21-18(22)14-26-20(24)11-5-10-19(23)25-13-15-6-4-9-17(12-15)27-16-7-2-1-3-8-16/h1-4,6-9,12,18H,5,10-11,13-14H2
InChIKey NXHURRGYZYMSAY-UHFFFAOYSA-N
Mol Weight 411.28 g/mol
Molecular Formula C20H20Cl2O5
Exact Mass 410.068779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5cko0JX89Oy
Name Glutaric acid, 2,2-dichloroethyl 3-phenoxybenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 410.068779139 u
Formula C20H20Cl2O5
InChI InChI=1S/C20H20Cl2O5/c21-18(22)14-26-20(24)11-5-10-19(23)25-13-15-6-4-9-17(12-15)27-16-7-2-1-3-8-16/h1-4,6-9,12,18H,5,10-11,13-14H2
InChIKey NXHURRGYZYMSAY-UHFFFAOYSA-N
Molecular Weight 411.281 g/mol
SMILES C(CCC(OCC(Cl)Cl)=O)C(OCC1=CC=CC(OC2=CC=CC=C2)=C1)=O