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1,3-dimethyl-7-propyl-8-vinyl-xanthine

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1,3-dimethyl-7-propyl-8-vinyl-xanthine
SpectraBase Compound ID 5Dsuh7XpX5k
InChI InChI=1S/C12H16N4O2/c1-5-7-16-8(6-2)13-10-9(16)11(17)15(4)12(18)14(10)3/h6H,2,5,7H2,1,3-4H3
InChIKey GSHZIYYZGRNJIZ-UHFFFAOYSA-N
Mol Weight 248.29 g/mol
Molecular Formula C12H16N4O2
Exact Mass 248.127326 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9AS6aHvvQhu
Name 1,3-dimethyl-7-propyl-8-vinyl-xanthine
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N4O2
InChI InChI=1S/C12H16N4O2/c1-5-7-16-8(6-2)13-10-9(16)11(17)15(4)12(18)14(10)3/h6H,2,5,7H2,1,3-4H3
InChIKey GSHZIYYZGRNJIZ-UHFFFAOYSA-N
Literature Reference Author E.NEMCEKOVA,A.RYBAR,G.NOSALOVA,J.ALFOELDI
Literature Reference Citation MH.CHEM.,126,799(1995)
Literature Reference DOI 10.1007/BF00807173
Molecular Weight 248.285 g/mol
Solvent CDCl3
Source File Reference UWGN51