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5-Methyl-2-thioxo-3-(2-tolyl)-4-imidazolidinone
SpectraBase Compound ID 6ixegp7hZHF
InChI InChI=1S/C11H12N2OS/c1-7-5-3-4-6-9(7)13-10(14)8(2)12-11(13)15/h3-6,8H,1-2H3,(H,12,15)
InChIKey BHKHZUBAGGRKMF-UHFFFAOYSA-N
Mol Weight 220.29 g/mol
Molecular Formula C11H12N2OS
Exact Mass 220.067034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AHdmygXdgoR
Name 5-Methyl-2-thioxo-3-(2-tolyl)-4-imidazolidinone
CAS Registry Number 62289-45-6
Comments TWO ADDITIONAL SIGNALS AT 16.18 PPM (C11) AND 16.83 PPM (C10) DUE TO ROTATIONAL ISOMERISM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H12N2OS
InChI InChI=1S/C11H12N2OS/c1-7-5-3-4-6-9(7)13-10(14)8(2)12-11(13)15/h3-6,8H,1-2H3,(H,12,15)
InChIKey BHKHZUBAGGRKMF-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-D6