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

*Links on SpectraBase are not permalinks.
6-BENZYL-5-ISOPROPYL-2-[(PHENYLCARBONYLMETHYL)-THIO]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID EvJvO8u92ik
InChI InChI=1S/C22H22N2O2S/c1-15(2)20-18(13-16-9-5-3-6-10-16)23-22(24-21(20)26)27-14-19(25)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3,(H,23,24,26)
InChIKey ZINFTRJVMLEPFN-UHFFFAOYSA-N
Mol Weight 378.49 g/mol
Molecular Formula C22H22N2O2S
Exact Mass 378.140199 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 FxNIqHX5kkE
Name 6-BENZYL-5-ISOPROPYL-2-[(PHENYLCARBONYLMETHYL)-THIO]-PYRIMIDIN-4(3H)-ONE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22N2O2S
InChI InChI=1S/C22H22N2O2S/c1-15(2)20-18(13-16-9-5-3-6-10-16)23-22(24-21(20)26)27-14-19(25)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3,(H,23,24,26)
InChIKey ZINFTRJVMLEPFN-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 378.489 g/mol
Sample ID 39883
Solvent DMSO-D6