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(5Z)-5-(1,3-BENZODIOXOL-5-YLMETHYLENE)-2-[(3-HYDROXYPROPYL)-THIO]-1-METHYL-1,5-DIHYDRO-4H-IMIDAZOL-4-ONE
SpectraBase Compound ID 6ZARBWTWRiJ
InChI InChI=1S/C15H16N2O4S/c1-17-11(14(19)16-15(17)22-6-2-5-18)7-10-3-4-12-13(8-10)21-9-20-12/h3-4,7-8,18H,2,5-6,9H2,1H3/b11-7-
InChIKey JKGPKJMHZLCYNB-XFFZJAGNSA-N
Mol Weight 320.36 g/mol
Molecular Formula C15H16N2O4S
Exact Mass 320.083078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4yl02Zatbo0
Name (5Z)-5-(1,3-BENZODIOXOL-5-YLMETHYLENE)-2-[(3-HYDROXYPROPYL)-THIO]-1-METHYL-1,5-DIHYDRO-4H-IMIDAZOL-4-ONE
Compound Number 6G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H16N2O4S
InChI InChI=1S/C15H16N2O4S/c1-17-11(14(19)16-15(17)22-6-2-5-18)7-10-3-4-12-13(8-10)21-9-20-12/h3-4,7-8,18H,2,5-6,9H2,1H3/b11-7-
InChIKey JKGPKJMHZLCYNB-XFFZJAGNSA-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 320.363 g/mol
Sample ID 159
Solvent DMSO-D6