For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
6-BENZYL-5-ETHYL-2-[(PHENYLCARBONYLMETHYL)-THIO]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID 2IOMy3OrrJN
InChI InChI=1S/C21H20N2O2S/c1-2-17-18(13-15-9-5-3-6-10-15)22-21(23-20(17)25)26-14-19(24)16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H,22,23,25)
InChIKey AALZEHMOBBTXIP-UHFFFAOYSA-N
Mol Weight 364.46 g/mol
Molecular Formula C21H20N2O2S
Exact Mass 364.124549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Fnj4H7ZU9j8
Name 6-BENZYL-5-ETHYL-2-[(PHENYLCARBONYLMETHYL)-THIO]-PYRIMIDIN-4(3H)-ONE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20N2O2S
InChI InChI=1S/C21H20N2O2S/c1-2-17-18(13-15-9-5-3-6-10-15)22-21(23-20(17)25)26-14-19(24)16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H,22,23,25)
InChIKey AALZEHMOBBTXIP-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 364.462 g/mol
Sample ID 39882
Solvent DMSO-D6