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6-BENZYL-5-ETHYL-1-[(METHYLTHIO)-METHYL]-URACIL
SpectraBase Compound ID C4HJ1YehdPd
InChI InChI=1S/C15H18N2O2S/c1-3-12-13(9-11-7-5-4-6-8-11)17(10-20-2)15(19)16-14(12)18/h4-8H,3,9-10H2,1-2H3,(H,16,18,19)
InChIKey GSYPRNTVAPHBIW-UHFFFAOYSA-N
Mol Weight 290.38 g/mol
Molecular Formula C15H18N2O2S
Exact Mass 290.108899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 97iK6QjFgQL
Name 6-BENZYL-5-ETHYL-1-[(METHYLTHIO)-METHYL]-URACIL
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18N2O2S
InChI InChI=1S/C15H18N2O2S/c1-3-12-13(9-11-7-5-4-6-8-11)17(10-20-2)15(19)16-14(12)18/h4-8H,3,9-10H2,1-2H3,(H,16,18,19)
InChIKey GSYPRNTVAPHBIW-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 290.380 g/mol
Solvent CDCl3
Source File Reference UWCS15741