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6-BENZYL-5-METHYL-2-[(4'-METHOXYPHENYLCARBONYLMETHYL)-THIO]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID 2RARpS8fxSm
InChI InChI=1S/C21H20N2O3S/c1-14-18(12-15-6-4-3-5-7-15)22-21(23-20(14)25)27-13-19(24)16-8-10-17(26-2)11-9-16/h3-11H,12-13H2,1-2H3,(H,22,23,25)
InChIKey AWUOYSOBVMQNFR-UHFFFAOYSA-N
Mol Weight 380.46 g/mol
Molecular Formula C21H20N2O3S
Exact Mass 380.119464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IusyvURGNiW
Name 6-BENZYL-5-METHYL-2-[(4'-METHOXYPHENYLCARBONYLMETHYL)-THIO]-PYRIMIDIN-4(3H)-ONE
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20N2O3S
InChI InChI=1S/C21H20N2O3S/c1-14-18(12-15-6-4-3-5-7-15)22-21(23-20(14)25)27-13-19(24)16-8-10-17(26-2)11-9-16/h3-11H,12-13H2,1-2H3,(H,22,23,25)
InChIKey AWUOYSOBVMQNFR-UHFFFAOYSA-N
Literature Reference Author Z.K.RAO,J.LONG,C.LI,S.S.ZHANG,M.HE,L.C.OU,Y.T.ZHENG,Y.P.HE
Literature Reference Citation MH.CHEM.,139,967(2008)
Literature Reference DOI 10.1007/s00706-007-0834-8
Molecular Weight 380.461 g/mol
Sample ID 39884
Solvent DMSO-D6