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ENDO-5-ETHOXY-1-(METHYLTHIO)-4-(TRIFLUOROACETYL)-7-OXA-2-THIABICYCLO-[2.2.1]-HEPTANE-3-ONE
SpectraBase Compound ID Iw55agpw6Wp
InChI InChI=1S/C10H11F3O4S2/c1-3-16-5-4-8(18-2)17-9(5,7(15)19-8)6(14)10(11,12)13/h5H,3-4H2,1-2H3/t5-,8+,9-/m1/s1
InChIKey SYBQWDRHKBLJHT-HFHMMWAZSA-N
Mol Weight 316.31 g/mol
Molecular Formula C10H11F3O4S2
Exact Mass 316.005086 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KWatdn1GfW4
Name ENDO-5-ETHOXY-1-(METHYLTHIO)-4-(TRIFLUOROACETYL)-7-OXA-2-THIABICYCLO-[2.2.1]-HEPTANE-3-ONE
CAS Registry Number 102435-81-4
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H11F3O4S2
InChI InChI=1S/C10H11F3O4S2/c1-3-16-5-4-8(18-2)17-9(5,7(15)19-8)6(14)10(11,12)13/h5H,3-4H2,1-2H3/t5-,8+,9-/m1/s1
InChIKey SYBQWDRHKBLJHT-HFHMMWAZSA-N
Literature Reference Author H.GOTTHARDT,H.G.KINZELMANN,U.FEIST,J.BUDDRUS
Literature Reference Citation CHEM.BER.,119,2317(1986)
Literature Reference DOI 10.1002/cber.19861190723
Solvent CDCl3
Source File Reference UWGB1617