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8-tert-Butyl 2-Ethyl 3-[(2,2-dimethylpropanoyl)amino]-6-chloro-quinoline-2,8-dicarboxylate 1-oxide
SpectraBase Compound ID 3tKJlgXaVsn
InChI InChI=1S/C22H27ClN2O6/c1-8-30-19(27)17-15(24-20(28)21(2,3)4)10-12-9-13(23)11-14(16(12)25(17)29)18(26)31-22(5,6)7/h9-11H,8H2,1-7H3,(H,24,28)
InChIKey HRGDKCKJOURRQZ-UHFFFAOYSA-N
Mol Weight 450.92 g/mol
Molecular Formula C22H27ClN2O6
Exact Mass 450.155764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6E8EBARMLBl
Name 8-tert-Butyl 2-Ethyl 3-[(2,2-dimethylpropanoyl)amino]-6-chloro-quinoline-2,8-dicarboxylate 1-oxide
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Formula C22H27ClN2O6
InChI InChI=1S/C22H27ClN2O6/c1-8-30-19(27)17-15(24-20(28)21(2,3)4)10-12-9-13(23)11-14(16(12)25(17)29)18(26)31-22(5,6)7/h9-11H,8H2,1-7H3,(H,24,28)
InChIKey HRGDKCKJOURRQZ-UHFFFAOYSA-N
Molecular Weight 450.919 g/mol
SMILES N(C(C(C)(C)C)=O)c1c([n+](c2c(C(OC(C)(C)C)=O)cc(cc2c1)Cl)[O-])C(=O)OCC
SPLASH splash10-0a4i-9013100000-57f164e8208beb0a247f
Source of Spectrum F-66-704-6p
Wiley ID 1684775