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5-METHYLCARBONYL-1-(2-CHLOROPHENYL)-2-(2,6-DIMETHYLPHENYL)-4,4-BIS-(TRIFLUOROMETHYL)-1,4,5,6-TETRAHYDROPYRIMIDINE

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5-METHYLCARBONYL-1-(2-CHLOROPHENYL)-2-(2,6-DIMETHYLPHENYL)-4,4-BIS-(TRIFLUOROMETHYL)-1,4,5,6-TETRAHYDROPYRIMIDINE
SpectraBase Compound ID 10IuSKb6xQO
InChI InChI=1S/C22H19ClF6N2O/c1-12-7-6-8-13(2)18(12)31-11-16(14(3)32)20(21(24,25)26,22(27,28)29)30-19(31)15-9-4-5-10-17(15)23/h4-10,16H,11H2,1-3H3
InChIKey BXGBETBMGPQYQW-UHFFFAOYSA-N
Mol Weight 476.85 g/mol
Molecular Formula C22H19ClF6N2O
Exact Mass 476.10901 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I7p1zmuYaAn
Name 5-METHYLCARBONYL-1-(2-CHLOROPHENYL)-2-(2,6-DIMETHYLPHENYL)-4,4-BIS-(TRIFLUOROMETHYL)-1,4,5,6-TETRAHYDROPYRIMIDINE
Compound Number 18C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19ClF6N2O
InChI InChI=1S/C22H19ClF6N2O/c1-12-7-6-8-13(2)18(12)31-11-16(14(3)32)20(21(24,25)26,22(27,28)29)30-19(31)15-9-4-5-10-17(15)23/h4-10,16H,11H2,1-3H3
InChIKey BXGBETBMGPQYQW-UHFFFAOYSA-N
Literature Reference Author J.CYRENER,K.BURGER
Literature Reference Citation MH.CHEM.,126,319(1995)
Literature Reference DOI 10.1007/BF00816101
Molecular Weight 476.849 g/mol
Solvent CDCl3
Source File Reference UWMK34