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DIMETHYL-(E)-2-[(TERT.-BUTYLAMINO)-CARBONYL]-3-[[[(PHENYL)-SULFONYL]-AMINO]-CARBONYL]-2-BUTENEDIOATE
SpectraBase Compound ID L5o3PQ0EkQs
InChI InChI=1S/C18H22N2O8S/c1-18(2,3)19-14(21)12(16(23)27-4)13(17(24)28-5)15(22)20-29(25,26)11-9-7-6-8-10-11/h6-10H,1-5H3,(H,19,21)(H,20,22)/b13-12+
InChIKey KQDQAKFVCGYNEI-OUKQBFOZSA-N
Mol Weight 426.44 g/mol
Molecular Formula C18H22N2O8S
Exact Mass 426.109687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID dZIsXDYRrH
Name DIMETHYL-(E)-2-[(TERT.-BUTYLAMINO)-CARBONYL]-3-[[[(PHENYL)-SULFONYL]-AMINO]-CARBONYL]-2-BUTENEDIOATE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22N2O8S
InChI InChI=1S/C18H22N2O8S/c1-18(2,3)19-14(21)12(16(23)27-4)13(17(24)28-5)15(22)20-29(25,26)11-9-7-6-8-10-11/h6-10H,1-5H3,(H,19,21)(H,20,22)/b13-12+
InChIKey KQDQAKFVCGYNEI-OUKQBFOZSA-N
Literature Reference Author A.ALIZADEH,S.ROSTAMNIA,N.ZOHREH,H.R.BIJANZADEH
Literature Reference Citation MH.CHEM.,139,49(2008)
Literature Reference DOI 10.1007/s00706-007-0754-7
Molecular Weight 426.441 g/mol
Sample ID 39612
Solvent CDCl3