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5-(4-THIOSEMICARBAZONOPHENYLOXYMETHYL)-2,2-DIMETHYL-2H-BENZIMIDAZOLE-1,3-DI-N-OXIDE
SpectraBase Compound ID AFKRYPgCwX3
InChI InChI=1S/C18H19N5O3S/c1-18(2)22(24)15-8-5-13(9-16(15)23(18)25)11-26-14-6-3-12(4-7-14)10-20-21-17(19)27/h3-10H,11H2,1-2H3,(H3,19,21,27)/b20-10+
InChIKey ZGOAFRNUECEGFZ-KEBDBYFISA-N
Mol Weight 385.44 g/mol
Molecular Formula C18H19N5O3S
Exact Mass 385.120861 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KhpPLnBYJcA
Name 5-(4-THIOSEMICARBAZONOPHENYLOXYMETHYL)-2,2-DIMETHYL-2H-BENZIMIDAZOLE-1,3-DI-N-OXIDE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H19N5O3S
InChI InChI=1S/C18H19N5O3S/c1-18(2)22(24)15-8-5-13(9-16(15)23(18)25)11-26-14-6-3-12(4-7-14)10-20-21-17(19)27/h3-10H,11H2,1-2H3,(H3,19,21,27)/b20-10+
InChIKey ZGOAFRNUECEGFZ-KEBDBYFISA-N
Literature Reference Author A.MERLINO,D.BENITEZ,S.CHAVEZ,J.DACUNHA,P.HERNANDEZ,L.W.TINOC O,N.E.CAMPILLO,J.A.P
Literature Reference Citation MEDCHEMCOMM,1,216(2010)
Literature Reference DOI 10.1039/c0md00085j
Molecular Weight 385.441 g/mol
Solvent DMSO-D6
Source File Reference UWLU80489