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(1R,3R,4R,7R)-7-HYDROXY-1-(HYDROXYMETHYL)-3-(THYMIN-1-YL)-5-(TRIFLUOROACETYL)-2-OXA-5-AZABICYCLO-[2.2.1]-HEPTANE
SpectraBase Compound ID 8SfxWpDT1UQ
InChI InChI=1S/C13H14F3N3O5/c1-6-2-18(5-17-9(6)22)10-7-8(21)12(4-20,24-10)3-19(7)11(23)13(14,15)16/h2,5,7-8,10,20-21H,3-4H2,1H3/t7-,8-,10-,12-/m1/s1
InChIKey FXQPAJACMHKFOS-FWSPBBIJSA-N
Mol Weight 349.27 g/mol
Molecular Formula C13H14F3N3O5
Exact Mass 349.088555 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IfLyDkn5QVl
Name (1R,3R,4R,7R)-7-HYDROXY-1-(HYDROXYMETHYL)-3-(THYMIN-1-YL)-5-(TRIFLUOROACETYL)-2-OXA-5-AZABICYCLO-[2.2.1]-HEPTANE
Compound Number 29
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14F3N3O5
InChI InChI=1S/C13H14F3N3O5/c1-6-2-18(5-17-9(6)22)10-7-8(21)12(4-20,24-10)3-19(7)11(23)13(14,15)16/h2,5,7-8,10,20-21H,3-4H2,1H3/t7-,8-,10-,12-/m1/s1
InChIKey FXQPAJACMHKFOS-FWSPBBIJSA-N
Literature Reference Author B.R.BABU,RAUNAK,N.E.POOPEIKO,M.JUHL,A.D.BOND,V.S.PARMAR,J.WE NGEL
Literature Reference Citation EUR.J.ORG.CHEM.,2297(2005)
Literature Reference DOI 10.1002/ejoc.200500023
Molecular Weight 349.266 g/mol
Sample ID 39319
Solvent DMSO-D6