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5-(4'-METHYLPHENYL)-SULFONYL-4-NITROIMIDAZOLE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5-(4'-METHYLPHENYL)-SULFONYL-4-NITROIMIDAZOLE
SpectraBase Compound ID 2fRuHn6wqEm
InChI InChI=1S/C10H9N3O4S/c1-7-2-4-8(5-3-7)18(16,17)10-9(13(14)15)11-6-12-10/h2-6H,1H3,(H,11,12)
InChIKey BKHJJAJOCIYLQU-UHFFFAOYSA-N
Mol Weight 267.26 g/mol
Molecular Formula C10H9N3O4S
Exact Mass 267.031377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FC6fnumYnXF
Name 5-(4'-METHYLPHENYL)-SULFONYL-4-NITROIMIDAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9N3O4S
InChI InChI=1S/C10H9N3O4S/c1-7-2-4-8(5-3-7)18(16,17)10-9(13(14)15)11-6-12-10/h2-6H,1H3,(H,11,12)
InChIKey BKHJJAJOCIYLQU-UHFFFAOYSA-N
Literature Reference Author S.KULKARNI,M.R.GRIMMETT
Literature Reference Citation AUSTR.J.CHEM.,40,1415(1987)
Literature Reference DOI 10.1071/ch9871415
Molecular Weight 267.259 g/mol
Solvent DMSO-D6
Source File Reference UWED6138