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4-CYANO-3-METHYL-2-(MORPHOLINOCARBONYL)-5-OXO-N-(TOSYLMETHYL)-2,5-DIHYDROFURAN-2-CARBOXAMIDE
SpectraBase Compound ID 4LXpp37lqG5
InChI InChI=1S/C20H21N3O7S/c1-13-3-5-15(6-4-13)31(27,28)12-22-18(25)20(14(2)16(11-21)17(24)30-20)19(26)23-7-9-29-10-8-23/h3-6H,7-10,12H2,1-2H3,(H,22,25)
InChIKey ITGDHSSMUPCYKX-UHFFFAOYSA-N
Mol Weight 447.46 g/mol
Molecular Formula C20H21N3O7S
Exact Mass 447.110021 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9vfB944Go29
Name 4-CYANO-3-METHYL-2-(MORPHOLINOCARBONYL)-5-OXO-N-(TOSYLMETHYL)-2,5-DIHYDROFURAN-2-CARBOXAMIDE
Compound Number 27A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21N3O7S
InChI InChI=1S/C20H21N3O7S/c1-13-3-5-15(6-4-13)31(27,28)12-22-18(25)20(14(2)16(11-21)17(24)30-20)19(26)23-7-9-29-10-8-23/h3-6H,7-10,12H2,1-2H3,(H,22,25)
InChIKey ITGDHSSMUPCYKX-UHFFFAOYSA-N
Literature Reference Author J.ROBBACH,K.HARMS,U.KOERT
Literature Reference Citation EUR.J.ORG.CHEM.,2014,993(2014)
Literature Reference DOI 10.1002/ejoc.201301548
Molecular Weight 447.463 g/mol
Solvent CDCl3
Source File Reference UWIR18257