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1-[1[(TERT.-BUTYL)-5-METHYL-2-(METHYLTHIO)-1H-IMIDAZOLE-4-YL)-ETHAN-1-ONE
SpectraBase Compound ID H2HB0intwtz
InChI InChI=1S/C11H18N2OS/c1-7-9(8(2)14)12-10(15-6)13(7)11(3,4)5/h1-6H3
InChIKey MCGXIAOOCMNVOQ-UHFFFAOYSA-N
Mol Weight 226.34 g/mol
Molecular Formula C11H18N2OS
Exact Mass 226.113984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45GWnc1uXdX
Name 1-[1[(TERT.-BUTYL)-5-METHYL-2-(METHYLTHIO)-1H-IMIDAZOLE-4-YL)-ETHAN-1-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H18N2OS
InChI InChI=1S/C11H18N2OS/c1-7-9(8(2)14)12-10(15-6)13(7)11(3,4)5/h1-6H3
InChIKey MCGXIAOOCMNVOQ-UHFFFAOYSA-N
Literature Reference Author A.PASCUAL
Literature Reference Citation HELV.CHIM.ACTA,74,531(1991)
Literature Reference DOI 10.1002/hlca.19910740309
Molecular Weight 226.337 g/mol
Solvent CDCl3
Source File Reference UWVP6402