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1-[3-(2,6-dichlorophenyl)-5-methyl-isoxazole-4-carbonyl]nipecotic acid ethyl ester
SpectraBase Compound ID 74RfAAIIgUA
InChI InChI=1S/C19H20Cl2N2O4/c1-3-26-19(25)12-6-5-9-23(10-12)18(24)15-11(2)27-22-17(15)16-13(20)7-4-8-14(16)21/h4,7-8,12H,3,5-6,9-10H2,1-2H3
InChIKey IFVMYXPDLZFVET-UHFFFAOYSA-N
Mol Weight 411.29 g/mol
Molecular Formula C19H20Cl2N2O4
Exact Mass 410.080013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KvcKSRaoZz
Name 1-[3-(2,6-dichlorophenyl)-5-methyl-isoxazole-4-carbonyl]nipecotic acid ethyl ester
Alternate Name(s) 1-[[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester Ethyl 1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine-3-carboxylate Ethyl 1-[3-(2,6-dichlorophenyl)-5-methyl-isoxazole-4-carbonyl]piperidine-3-carboxylate Ethyl 1-[[3-[2,6-bis(chloranyl)phenyl]-5-methyl-1,2-oxazol-4-yl]carbonyl]piperidine-3-carboxylate
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Formula C19H20Cl2N2O4
InChI InChI=1S/C19H20Cl2N2O4/c1-3-26-19(25)12-6-5-9-23(10-12)18(24)15-11(2)27-22-17(15)16-13(20)7-4-8-14(16)21/h4,7-8,12H,3,5-6,9-10H2,1-2H3
InChIKey IFVMYXPDLZFVET-UHFFFAOYSA-N
Molecular Weight 411.285 g/mol
SMILES Cc1c(c(no1)-c1c(cccc1Cl)Cl)C(N1CCCC(C1)C(OCC)=O)=O
SPLASH splash10-052f-9533000000-f1cbaf666f02305a5907
Wiley ID 1466143