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5-ETHYL-2-[(PHENYLETHYL)-THIO]-6-(1-NAPHTHYLMETHYL)-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID 8pHGXEW1s1g
InChI InChI=1S/C25H24N2OS/c1-2-21-23(17-20-13-8-12-19-11-6-7-14-22(19)20)26-25(27-24(21)28)29-16-15-18-9-4-3-5-10-18/h3-14H,2,15-17H2,1H3,(H,26,27,28)
InChIKey JFGJUCMIAMVPIS-UHFFFAOYSA-N
Mol Weight 400.54 g/mol
Molecular Formula C25H24N2OS
Exact Mass 400.160935 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GDz1oQOG1Rp
Name 5-ETHYL-2-[(PHENYLETHYL)-THIO]-6-(1-NAPHTHYLMETHYL)-PYRIMIDIN-4(3H)-ONE
Compound Number 2Q
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24N2OS
InChI InChI=1S/C25H24N2OS/c1-2-21-23(17-20-13-8-12-19-11-6-7-14-22(19)20)26-25(27-24(21)28)29-16-15-18-9-4-3-5-10-18/h3-14H,2,15-17H2,1H3,(H,26,27,28)
InChIKey JFGJUCMIAMVPIS-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 400.538 g/mol
Sample ID 39897
Solvent DMSO-D6