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(5Z)-5-(2,3-DYHYDRO-1,4-BENZODIOXAN-6-YLMETHYLENE)-1-METHYL-2-THIOXOIMIDAZOLIDIN-4-ONE
SpectraBase Compound ID LnnT7WMx1VW
InChI InChI=1S/C13H12N2O3S/c1-15-9(12(16)14-13(15)19)6-8-2-3-10-11(7-8)18-5-4-17-10/h2-3,6-7H,4-5H2,1H3,(H,14,16,19)/b9-6-
InChIKey JBJOHWCYPPFOBI-TWGQIWQCSA-N
Mol Weight 276.31 g/mol
Molecular Formula C13H12N2O3S
Exact Mass 276.056863 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID umMzkSCcav
Name (5Z)-5-(2,3-DYHYDRO-1,4-BENZODIOXAN-6-YLMETHYLENE)-1-METHYL-2-THIOXOIMIDAZOLIDIN-4-ONE
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12N2O3S
InChI InChI=1S/C13H12N2O3S/c1-15-9(12(16)14-13(15)19)6-8-2-3-10-11(7-8)18-5-4-17-10/h2-3,6-7H,4-5H2,1H3,(H,14,16,19)/b9-6-
InChIKey JBJOHWCYPPFOBI-TWGQIWQCSA-N
Literature Reference Author K.BOURAHLA,L.PAQUIN,O.LOZACH,L.MEIJER,F.CARREAUX,J.P.BAZUREA U
Literature Reference Citation MOLECULES,16,7377(2011)
Literature Reference DOI 10.3390/molecules16097377
Molecular Weight 276.310 g/mol
Sample ID 152
Solvent DMSO-D6