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(S(S),3S)-ETHYL-N-(PARA-TOLYLSULFINYL)-3-AMINO-2,2-DIFLUORO-3-(PARA-FLUORO-PHENYL)-PROPANOATE
SpectraBase Compound ID 5Xo2QkjJpM3
InChI InChI=1S/C18H18F3NO3S/c1-3-25-17(23)18(20,21)16(13-6-8-14(19)9-7-13)22-26(24)15-10-4-12(2)5-11-15/h4-11,16,22H,3H2,1-2H3/t16-,26?/m1/s1
InChIKey BIDCILUJCVBEHU-DIERRCTGSA-N
Mol Weight 385.4 g/mol
Molecular Formula C18H18F3NO3S
Exact Mass 385.095949 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ki1u4JQv0rv
Name (S(S),3S)-ETHYL-N-(PARA-TOLYLSULFINYL)-3-AMINO-2,2-DIFLUORO-3-(PARA-FLUORO-PHENYL)-PROPANOATE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18F3NO3S
InChI InChI=1S/C18H18F3NO3S/c1-3-25-17(23)18(20,21)16(13-6-8-14(19)9-7-13)22-26(24)15-10-4-12(2)5-11-15/h4-11,16,22H,3H2,1-2H3/t16-,26?/m1/s1
InChIKey BIDCILUJCVBEHU-DIERRCTGSA-N
Literature Reference Author A.SOROCHINSKY,N.VOLOSHIN,A.MARKOVSKY,M.BELIK,N.YASUDA,H.UEKU SA,T.ONO,D.O.BERBASO
Literature Reference Citation J.ORG.CHEM.,68,7448(2003)
Literature Reference DOI 10.1021/jo030082k
Solvent CDCl3
Source File Reference UWMS26372