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(R)-DIETHYL-2-[2-(5-FLUORO-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)-ACETAMIDO]-SUCCINATE
SpectraBase Compound ID 5EOo7wP47ym
InChI InChI=1S/2C14H18FN3O7/c2*1-3-24-11(20)5-9(13(22)25-4-2)16-10(19)7-18-6-8(15)12(21)17-14(18)23/h2*6,9H,3-5,7H2,1-2H3,(H,16,19)(H,17,21,23)/t2*9-/m00/s1
InChIKey ZHHZFSDDHMVFLU-XFNAGHOKSA-N
Mol Weight 718.62 g/mol
Molecular Formula C28H36F2N6O14
Exact Mass 718.225756 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID foU0kFTbms
Name (R)-DIETHYL-2-[2-(5-FLUORO-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)-ACETAMIDO]-SUCCINATE
Compound Number 2H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36F2N6O14
InChI InChI=1S/2C14H18FN3O7/c2*1-3-24-11(20)5-9(13(22)25-4-2)16-10(19)7-18-6-8(15)12(21)17-14(18)23/h2*6,9H,3-5,7H2,1-2H3,(H,16,19)(H,17,21,23)/t2*9-/m00/s1
InChIKey ZHHZFSDDHMVFLU-XFNAGHOKSA-N
Literature Reference Author J.XIONG,H.F.ZHU,Y.J.ZHAO,Y.J.LAN,J.W.JIANG,J.J.YANG,S.F.ZHAN G
Literature Reference Citation MOLECULES,14,3142(2009)
Literature Reference DOI 10.3390/molecules14093142
Molecular Weight 718.622 g/mol
Sample ID 69680
Solvent DMSO-D6