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ZURNPGAXFIXSQB-UHFFFAOYSA-N
SpectraBase Compound ID IQecXRZsryK
InChI InChI=1S/2C8H13F3N2O2/c2*1-3-15-6-4-7(14,8(9,10)11)13-5(2)12-6/h2*6,14H,3-4H2,1-2H3,(H,12,13)
InChIKey ZURNPGAXFIXSQB-UHFFFAOYSA-N
Mol Weight 452.4 g/mol
Molecular Formula C16H26F6N4O4
Exact Mass 452.185824 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2eyDs0PmMA0
Name ZURNPGAXFIXSQB-UHFFFAOYSA-N
Compound Number 6-ETHOXY-4-HYDROXY-#3D2-METHYL-4-TRIFLUOROME THYL-3,4,5,6-TETRAHYDROPYRIMIDINE;2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H26F6N4O4
InChI InChI=1S/2C8H13F3N2O2/c2*1-3-15-6-4-7(14,8(9,10)11)13-5(2)12-6/h2*6,14H,3-4H2,1-2H3,(H,12,13)
InChIKey ZURNPGAXFIXSQB-UHFFFAOYSA-N
Literature Reference Author N.ZANATTA,M.B.FAGUNDES,R.ELLENSOHN,M.MARQUES,H.G.BONACORSO,M .A.P.MARTINS
Literature Reference Citation J.HETCYCL.CHEM.,35,451(1998)
Literature Reference DOI 10.1002/jhet.5570350231
Molecular Weight 452.397 g/mol
Solvent DMSO-D6
Source File Reference UWCS25494