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1-(4'-CARBOXYBUTYL)-THYMINE

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1-(4'-CARBOXYBUTYL)-THYMINE
SpectraBase Compound ID 9OitdJ5IK7r
InChI InChI=1S/C10H14N2O4/c1-7-6-12(10(16)11-9(7)15)5-3-2-4-8(13)14/h6H,2-5H2,1H3,(H,13,14)(H,11,15,16)
InChIKey ZKGQQVUQHLRLHL-UHFFFAOYSA-N
Mol Weight 226.23 g/mol
Molecular Formula C10H14N2O4
Exact Mass 226.095357 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6pvAJIwPbCJ
Name 1-(4'-CARBOXYBUTYL)-THYMINE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H14N2O4
InChI InChI=1S/C10H14N2O4/c1-7-6-12(10(16)11-9(7)15)5-3-2-4-8(13)14/h6H,2-5H2,1H3,(H,13,14)(H,11,15,16)
InChIKey ZKGQQVUQHLRLHL-UHFFFAOYSA-N
Literature Reference Author N.M.GARRIDO,D.DIEZ,S.H.DOMINGUEZ,M.R.SANCHEZ,M.GARCIA,J.G.UR ONES
Literature Reference Citation MOLECULES,11,435(2006)
Literature Reference DOI 10.3390/11060435
Molecular Weight 226.232 g/mol
Sample ID 38570
Solvent CDCl3