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4-HYDROXY-2-METHYL-4-TRIFLUOROMETHYL-1,4,4A,5,6,7A-HEXAHYDROFURO-[2,3-D]-PYRIMIDINE
SpectraBase Compound ID C89a96XEPcQ
InChI InChI=1S/2C8H11F3N2O2/c2*1-4-12-6-5(2-3-15-6)7(14,13-4)8(9,10)11/h2*5-6,14H,2-3H2,1H3,(H,12,13)
InChIKey OTIGQQVLVXLJPU-UHFFFAOYSA-N
Mol Weight 448.37 g/mol
Molecular Formula C16H22F6N4O4
Exact Mass 448.154524 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8KVjlgqIUau
Name 4-HYDROXY-2-METHYL-4-TRIFLUOROMETHYL-1,4,4A,5,6,7A-HEXAHYDROFURO-[2,3-D]-PYRIMIDINE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22F6N4O4
InChI InChI=1S/2C8H11F3N2O2/c2*1-4-12-6-5(2-3-15-6)7(14,13-4)8(9,10)11/h2*5-6,14H,2-3H2,1H3,(H,12,13)
InChIKey OTIGQQVLVXLJPU-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 448.365 g/mol
Solvent DMSO-D6
Source File Reference UWCS25495