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[1,3-(15)N(2)-2,4-(13)C(2)]-THYMINE

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[1,3-(15)N(2)-2,4-(13)C(2)]-THYMINE
SpectraBase Compound ID 3HUaTMlPdpL
InChI InChI=1S/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2H,1H3,(H2,6,7,8,9)/i4+1,5+1,6+1,7+1
InChIKey RWQNBRDOKXIBIV-SQLBHGNYSA-N
Mol Weight 130.09 g/mol
Molecular Formula C313C2H615N2O2
Exact Mass 130.043707 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6MlihO3hX9t
Name [1,3-(15)N(2)-2,4-(13)C(2)]-THYMINE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H615N2O2
InChI InChI=1S/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2H,1H3,(H2,6,7,8,9)/i4+1,5+1,6+1,7+1
InChIKey RWQNBRDOKXIBIV-SQLBHGNYSA-N
Literature Reference Author N.OUWERKERK,M.STEENWEG,M.D.RUIJTER,J.BROUWER,J.H.V.BOOM,J.LU GTENBURG,J.RAAP
Literature Reference Citation J.ORG.CHEM.,67,1480(2002)
Literature Reference DOI 10.1021/jo0107249
Solvent DMSO-D6
Source File Reference UWMS23363