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2-(3'-ETHOXYCARBONYL-UREIDO)-3-ETHOXYCARBONYL-5,6,7,8-TETRAHYDRO-4H-CYCLOHEPTA-[B]-THIOPHENE
SpectraBase Compound ID IdFqfTVHGqm
InChI InChI=1S/C16H22N2O5S/c1-3-22-14(19)12-10-8-6-5-7-9-11(10)24-13(12)17-15(20)18-16(21)23-4-2/h3-9H2,1-2H3,(H2,17,18,20,21)
InChIKey WJLJEUGUGNDZOB-UHFFFAOYSA-N
Mol Weight 354.42 g/mol
Molecular Formula C16H22N2O5S
Exact Mass 354.124943 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JM7K0Zd6CaP
Name 2-(3'-ETHOXYCARBONYL-UREIDO)-3-ETHOXYCARBONYL-5,6,7,8-TETRAHYDRO-4H-CYCLOHEPTA-[B]-THIOPHENE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22N2O5S
InChI InChI=1S/C16H22N2O5S/c1-3-22-14(19)12-10-8-6-5-7-9-11(10)24-13(12)17-15(20)18-16(21)23-4-2/h3-9H2,1-2H3,(H2,17,18,20,21)
InChIKey WJLJEUGUGNDZOB-UHFFFAOYSA-N
Literature Reference Author K.M.AL-TAISAN,H.M.A.AL-HAZIMI,S.S.AL-SHIHRY
Literature Reference Citation MOLECULES,15,3932(2010)
Literature Reference DOI 10.3390/molecules15063932
Molecular Weight 354.421 g/mol
Sample ID 70948
Solvent CDCl3