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DIMETHYL-[S-(S),2S,3R]-(-)-N-(PARA-TOLUENESULFINYL)-3-(PARA-TRIFLUOROMETHYLPHENYL)-AZIRIDINE-2-PHOSPHONATE
SpectraBase Compound ID BVsHcmtBwzd
InChI InChI=1S/C18H19F3NO4PS/c1-12-4-10-15(11-5-12)28(24)22-16(17(22)27(23,25-2)26-3)13-6-8-14(9-7-13)18(19,20)21/h4-11,16-17H,1-3H3/t16-,17-,22?,28?/m1/s1
InChIKey RFJMZNVYYCRLLY-YEKPTHQLSA-N
Mol Weight 433.38 g/mol
Molecular Formula C18H19F3NO4PS
Exact Mass 433.072451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7qe9sPVo1ps
Name DIMETHYL-[S-(S),2S,3R]-(-)-N-(PARA-TOLUENESULFINYL)-3-(PARA-TRIFLUOROMETHYLPHENYL)-AZIRIDINE-2-PHOSPHONATE
Compound Number 22D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H19F3NO4PS
InChI InChI=1S/C18H19F3NO4PS/c1-12-4-10-15(11-5-12)28(24)22-16(17(22)27(23,25-2)26-3)13-6-8-14(9-7-13)18(19,20)21/h4-11,16-17H,1-3H3/t16-,17-,22?,28?/m1/s1
InChIKey RFJMZNVYYCRLLY-YEKPTHQLSA-N
Literature Reference Author F.A.DAVIS,Y.WU,H.YAN,W.MCCOULL,K.R.PRASAD
Literature Reference Citation J.ORG.CHEM.,68,2410(2003)
Literature Reference DOI 10.1021/jo020707z
Molecular Weight 433.382 g/mol
Solvent CDCl3
Source File Reference UWVN25246