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(-)-(2S,S(S))-3-CHLORO-3,3-DIFLUORO-N-(PARA-METHOXYPHENYL)-2-AMINOPROPYL-1-(1-NAPHTHYL)-SULFOXIDE
SpectraBase Compound ID FVO9aFzixik
InChI InChI=1S/2C20H18ClF2NO2S/c2*1-26-16-11-9-15(10-12-16)24-19(20(21,22)23)13-27(25)18-8-4-6-14-5-2-3-7-17(14)18/h2*2-12,19,24H,13H2,1H3/t2*19-,27?/m11/s1
InChIKey JIHDBOBQOUBMHB-BZWNNCCASA-N
Mol Weight 819.76 g/mol
Molecular Formula C40H36Cl2F4N2O4S2
Exact Mass 818.142968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Zdswdqki5e
Name (-)-(2S,S(S))-3-CHLORO-3,3-DIFLUORO-N-(PARA-METHOXYPHENYL)-2-AMINOPROPYL-1-(1-NAPHTHYL)-SULFOXIDE
Compound Number SYN-4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H36Cl2F4N2O4S2
InChI InChI=1S/2C20H18ClF2NO2S/c2*1-26-16-11-9-15(10-12-16)24-19(20(21,22)23)13-27(25)18-8-4-6-14-5-2-3-7-17(14)18/h2*2-12,19,24H,13H2,1H3/t2*19-,27?/m11/s1
InChIKey JIHDBOBQOUBMHB-BZWNNCCASA-N
Literature Reference Author S.FUSTERO,A.NAVARRO,B.PINA,J.G.SOLER,A.BARTOLOME,A.ASENSIO,A .SIMON,P.BRAVO,G.FRO
Literature Reference Citation ORG.LETTERS,3,2621(2001)
Literature Reference DOI 10.1021/ol016087q
Molecular Weight 819.756 g/mol
Sample ID 27370
Solvent CDCl3