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2-(2,5-DIMETHYLPHENOXY)-3-(4-CHLOROPHENYL)-5-METHYL-PYRIMIDO-[5,4-C]-QUINOLIN-4(3H)-ONE
SpectraBase Compound ID Kir92TRxoX4
InChI InChI=1S/C26H20ClN3O2/c1-15-8-9-16(2)22(14-15)32-26-29-24-20-6-4-5-7-21(20)28-17(3)23(24)25(31)30(26)19-12-10-18(27)11-13-19/h4-14H,1-3H3
InChIKey KITSQHPRPWJWLQ-UHFFFAOYSA-N
Mol Weight 441.92 g/mol
Molecular Formula C26H20ClN3O2
Exact Mass 441.124405 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 96a45OrBzX1
Name 2-(2,5-DIMETHYLPHENOXY)-3-(4-CHLOROPHENYL)-5-METHYL-PYRIMIDO-[5,4-C]-QUINOLIN-4(3H)-ONE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H20ClN3O2
InChI InChI=1S/C26H20ClN3O2/c1-15-8-9-16(2)22(14-15)32-26-29-24-20-6-4-5-7-21(20)28-17(3)23(24)25(31)30(26)19-12-10-18(27)11-13-19/h4-14H,1-3H3
InChIKey KITSQHPRPWJWLQ-UHFFFAOYSA-N
Literature Reference Author Y.AI,G.YANG,J.LIU,Y.CHEN,L.LIU,X.LEI
Literature Reference Citation MAGN.RES.CHEM.,48,955(2010)
Literature Reference DOI 10.1002/mrc.2689
Molecular Weight 441.917 g/mol
Solvent CDCl3
Source File Reference UWIR16902