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3-ETHYL-5-METHYL-4-(2-CHLOROPHENYL)-2-[[2-(TRIFLUOROMETHYLSULFONAMIDO)-ETHOXY]-METHYL]-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
SpectraBase Compound ID LlZC28pa6AT
InChI InChI=1S/C21H24ClF3N2O7S/c1-4-34-20(29)18-15(11-33-10-9-26-35(30,31)21(23,24)25)27-12(2)16(19(28)32-3)17(18)13-7-5-6-8-14(13)22/h5-8,17,26-27H,4,9-11H2,1-3H3
InChIKey AYPDBZFGHKOQEK-UHFFFAOYSA-N
Mol Weight 540.94 g/mol
Molecular Formula C21H24ClF3N2O7S
Exact Mass 540.094484 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1vTCvsVhSGP
Name 3-ETHYL-5-METHYL-4-(2-CHLOROPHENYL)-2-[[2-(TRIFLUOROMETHYLSULFONAMIDO)-ETHOXY]-METHYL]-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24ClF3N2O7S
InChI InChI=1S/C21H24ClF3N2O7S/c1-4-34-20(29)18-15(11-33-10-9-26-35(30,31)21(23,24)25)27-12(2)16(19(28)32-3)17(18)13-7-5-6-8-14(13)22/h5-8,17,26-27H,4,9-11H2,1-3H3
InChIKey AYPDBZFGHKOQEK-UHFFFAOYSA-N
Literature Reference Author V.L.R.SANA,V.R.KATLA,S.CHENNAMSETTY,A.SHAIK,N.R.CHAMARTHI
Literature Reference Citation D.PHARM.SINICA,4,10(2013)
Molecular Weight 540.939 g/mol
Solvent CDCl3
Source File Reference UWLU78015