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Ethyl 1-[1-(3,4-dichlorophenyl)-2,5-dioxo-3-pyrrolidinyl]-3-piperidinecarboxylate
SpectraBase Compound ID 5VpcPuqNTAo
InChI InChI=1S/C18H20Cl2N2O4/c1-2-26-18(25)11-4-3-7-21(10-11)15-9-16(23)22(17(15)24)12-5-6-13(19)14(20)8-12/h5-6,8,11,15H,2-4,7,9-10H2,1H3
InChIKey AFOURSBHZGYIQY-UHFFFAOYSA-N
Mol Weight 399.27 g/mol
Molecular Formula C18H20Cl2N2O4
Exact Mass 398.080013 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KxipnyS4ZdX
Name Ethyl 1-[1-(3,4-dichlorophenyl)-2,5-dioxo-3-pyrrolidinyl]-3-piperidinecarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 398.080012528 u
Formula C18H20Cl2N2O4
InChI InChI=1S/C18H20Cl2N2O4/c1-2-26-18(25)11-4-3-7-21(10-11)15-9-16(23)22(17(15)24)12-5-6-13(19)14(20)8-12/h5-6,8,11,15H,2-4,7,9-10H2,1H3
InChIKey AFOURSBHZGYIQY-UHFFFAOYSA-N
Molecular Weight 399.274 g/mol
SMILES CCOC(C1CN(C2C(N(C(C2)=O)C2=CC(Cl)=C(C=C2)Cl)=O)CCC1)=O