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1-(2-Isopropylquinazolin-4-yl)-2-naphthyl(trifluoromethyl)sulfonate
SpectraBase Compound ID KLhMWHfBkgE
InChI InChI=1S/C22H17F3N2O3S/c1-13(2)21-26-17-10-6-5-9-16(17)20(27-21)19-15-8-4-3-7-14(15)11-12-18(19)30-31(28,29)22(23,24)25/h3-13H,1-2H3
InChIKey GAMGZYPZGVWKMI-UHFFFAOYSA-N
Mol Weight 446.44 g/mol
Molecular Formula C22H17F3N2O3S
Exact Mass 446.091198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jzhfm798C5e
Name 1-(2-ISOPROPYL-QUINAZOLIN-4-YL)-2-NAPHTHYL-(TRIFLUOROMETHYL)-SULFONATE
Compound Number 13E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H17F3N2O3S
InChI InChI=1S/C22H17F3N2O3S/c1-13(2)21-26-17-10-6-5-9-16(17)20(27-21)19-15-8-4-3-7-14(15)11-12-18(19)30-31(28,29)22(23,24)25/h3-13H,1-2H3
InChIKey GAMGZYPZGVWKMI-UHFFFAOYSA-N
Literature Reference Author D.J.CONNOLY,P.M.LACEY,M.MCCARTHY,C.P.SAUNDERS,A.M.CARROLL,R. GODDARD,P.J.GUIRY
Literature Reference Citation J.ORG.CHEM.,69,6572(2004)
Literature Reference DOI 10.1021/jo049195+
Molecular Weight 446.444 g/mol
Solvent CDCl3
Source File Reference UWVN22471