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6-(3,5-DIMETHYLPHENYL)-5-ETHYL-1-[(METHYLTHIO)-METHYL]-URACIL
SpectraBase Compound ID 2AFK1b2RdQi
InChI InChI=1S/C17H22N2O2S/c1-5-14-15(9-13-7-11(2)6-12(3)8-13)19(10-22-4)17(21)18-16(14)20/h6-8H,5,9-10H2,1-4H3,(H,18,20,21)
InChIKey UDLWDTVVAGHDKN-UHFFFAOYSA-N
Mol Weight 318.44 g/mol
Molecular Formula C17H22N2O2S
Exact Mass 318.140199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Eq4Qdz7QNs
Name 6-(3,5-DIMETHYLPHENYL)-5-ETHYL-1-[(METHYLTHIO)-METHYL]-URACIL
Compound Number 8E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22N2O2S
InChI InChI=1S/C17H22N2O2S/c1-5-14-15(9-13-7-11(2)6-12(3)8-13)19(10-22-4)17(21)18-16(14)20/h6-8H,5,9-10H2,1-4H3,(H,18,20,21)
InChIKey UDLWDTVVAGHDKN-UHFFFAOYSA-N
Literature Reference Author K.DANEL,E.LARSEN,E.B.PEDERSEN,B.F.VESTERGAARD,C.NIELSEN
Literature Reference Citation J.MED.CHEM.,39,2427(1996)
Literature Reference DOI 10.1021/jm9600499
Molecular Weight 318.434 g/mol
Solvent CDCl3
Source File Reference UWCS15745