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2-(3-Chlorophenyl)-3-methyl-N-(4-sec-butylphenyl)cinchoninamide
SpectraBase Compound ID DiyGa1ETrNs
InChI InChI=1S/C27H25ClN2O/c1-4-17(2)19-12-14-22(15-13-19)29-27(31)25-18(3)26(20-8-7-9-21(28)16-20)30-24-11-6-5-10-23(24)25/h5-17H,4H2,1-3H3,(H,29,31)
InChIKey RGSRZFKDRJWART-UHFFFAOYSA-N
Mol Weight 428.96 g/mol
Molecular Formula C27H25ClN2O
Exact Mass 428.165541 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YrDQ8MCW00
Name 2-(3-Chlorophenyl)-3-methyl-N-(4-sec-butylphenyl)cinchoninamide
Alternate Name(s) 2-(3-Chlorophenyl)-3-methyl-N-(4-sec-butylphenyl)quinoline-4-carboxamide N-(4-butan-2-ylphenyl)-2-(3-chlorophenyl)-3-methyl-4-quinolinecarboxamide N-(4-butan-2-ylphenyl)-2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxamide
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Formula C27H25ClN2O
InChI InChI=1S/C27H25ClN2O/c1-4-17(2)19-12-14-22(15-13-19)29-27(31)25-18(3)26(20-8-7-9-21(28)16-20)30-24-11-6-5-10-23(24)25/h5-17H,4H2,1-3H3,(H,29,31)
InChIKey RGSRZFKDRJWART-UHFFFAOYSA-N
Molecular Weight 428.963 g/mol
SMILES N(C(c1c2c(cccc2)nc(c1C)-c1cccc(c1)Cl)=O)c1ccc(cc1)C(CC)C
SPLASH splash10-0159-2291200000-372c075612ba69f3fa09
Wiley ID 1454243