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7-(2-hydroxybutyl)-1,3-dimethyl-8-vinyl-xanthine
SpectraBase Compound ID BHD2qrKXKlr
InChI InChI=1S/C13H18N4O3/c1-5-8(18)7-17-9(6-2)14-11-10(17)12(19)16(4)13(20)15(11)3/h6,8,18H,2,5,7H2,1,3-4H3
InChIKey TXUQEXUKEKVQBG-UHFFFAOYSA-N
Mol Weight 278.31 g/mol
Molecular Formula C13H18N4O3
Exact Mass 278.13789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AHyWgyVD6fa
Name 7-(2-hydroxybutyl)-1,3-dimethyl-8-vinyl-xanthine
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18N4O3
InChI InChI=1S/C13H18N4O3/c1-5-8(18)7-17-9(6-2)14-11-10(17)12(19)16(4)13(20)15(11)3/h6,8,18H,2,5,7H2,1,3-4H3
InChIKey TXUQEXUKEKVQBG-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 278.311 g/mol
Solvent CDCl3
Source File Reference UWGN57