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5-Methyl-3-(2-methyl-4-nitro-phenyl)-2-thioxo-4-imidazolidinone
SpectraBase Compound ID 73nU669qOZt
InChI InChI=1S/C11H11N3O3S/c1-6-5-8(14(16)17)3-4-9(6)13-10(15)7(2)12-11(13)18/h3-5,7H,1-2H3,(H,12,18)
InChIKey FVKGXTNONHVONU-UHFFFAOYSA-N
Mol Weight 265.29 g/mol
Molecular Formula C11H11N3O3S
Exact Mass 265.052112 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtekZmY5jaG
Name 5-Methyl-3-(2-methyl-4-nitro-phenyl)-2-thioxo-4-imidazolidinone
CAS Registry Number 78334-98-2
Comments ADDITIONAL SIGNALS AT 15.34 (C11) AND 16.94 PPM (C10) DUE TO ROTATIONAL ISOMERISM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H11N3O3S
InChI InChI=1S/C11H11N3O3S/c1-6-5-8(14(16)17)3-4-9(6)13-10(15)7(2)12-11(13)18/h3-5,7H,1-2H3,(H,12,18)
InChIKey FVKGXTNONHVONU-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference M.A. Khadim, L.D. Colebrook, Org. Magn. Resonance 15, 225 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO