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(+)-(E,S(S),2S,3R)-5-(N-METHYL-S-PHENYLSULFONIMIDOYL)-3-METHYL-2-(2-METHYLPROPANE-2-SULFONYLAMINO)-PENT-4-ENOIC-ACID-ETHYLESTER

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(+)-(E,S(S),2S,3R)-5-(N-METHYL-S-PHENYLSULFONIMIDOYL)-3-METHYL-2-(2-METHYLPROPANE-2-SULFONYLAMINO)-PENT-4-ENOIC-ACID-ETHYLESTER
SpectraBase Compound ID 1hmbPB0ZBz7
InChI InChI=1S/C19H30N2O5S2/c1-7-26-18(22)17(21-28(24,25)19(3,4)5)15(2)13-14-27(23,20-6)16-11-9-8-10-12-16/h8-15,17,21H,7H2,1-6H3/b14-13+/t15-,17-,27?/m0/s1
InChIKey JVTDHRXFYQUMFD-KFFYMERPSA-N
Mol Weight 430.58 g/mol
Molecular Formula C19H30N2O5S2
Exact Mass 430.159614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IMTcFTImIN3
Name (+)-(E,S(S),2S,3R)-5-(N-METHYL-S-PHENYLSULFONIMIDOYL)-3-METHYL-2-(2-METHYLPROPANE-2-SULFONYLAMINO)-PENT-4-ENOIC-ACID-ETHYLESTER
Compound Number 2G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H30N2O5S2
InChI InChI=1S/C19H30N2O5S2/c1-7-26-18(22)17(21-28(24,25)19(3,4)5)15(2)13-14-27(23,20-6)16-11-9-8-10-12-16/h8-15,17,21H,7H2,1-6H3/b14-13+/t15-,17-,27?/m0/s1
InChIKey JVTDHRXFYQUMFD-KFFYMERPSA-N
Literature Reference Author M.SCHLEUSNER,H.J.GAIS,S.KOEP,G.RAABE
Literature Reference Citation J.AM.CHEM.SOC.,124,7789(2002)
Literature Reference DOI 10.1021/ja0201799
Molecular Weight 430.578 g/mol
Sample ID 49721
Solvent CDCl3