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1-(PHENYL)-3-(2-CHLORO-3-QUINOLINYL)-1,1-DICYANE-METHYL-1-PROPANONE
SpectraBase Compound ID 3cd5qy0Nogw
InChI InChI=1S/C21H14ClN3O/c22-21-18(10-15-8-4-5-9-19(15)25-21)17(16(12-23)13-24)11-20(26)14-6-2-1-3-7-14/h1-10,16-17H,11H2
InChIKey WHOJUYHVNRJWKN-UHFFFAOYSA-N
Mol Weight 359.82 g/mol
Molecular Formula C21H14ClN3O
Exact Mass 359.08254 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1qk4fYaq0FB
Name 1-(PHENYL)-3-(2-CHLORO-3-QUINOLINYL)-1,1-DICYANE-METHYL-1-PROPANONE
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H14ClN3O
InChI InChI=1S/C21H14ClN3O/c22-21-18(10-15-8-4-5-9-19(15)25-21)17(16(12-23)13-24)11-20(26)14-6-2-1-3-7-14/h1-10,16-17H,11H2
InChIKey WHOJUYHVNRJWKN-UHFFFAOYSA-N
Literature Reference Author S.N.LOPEZ,M.V.CASTELLI,S.A.ZACCHINO,J.N.DOMINGUEZ,G.LOBO,J.C HARRIS-CHARRIS,J.C.G
Literature Reference Citation BIOORG.MED.CHEM.,9,1999(2001)
Literature Reference DOI 10.1016/S0968-0896(01)00116-X
Molecular Weight 359.815 g/mol
Solvent CDCl3
Source File Reference UWMS22098