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#12-BETA+13-BETA;MAJOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9S,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENTAD
SpectraBase Compound ID 33rBQIcRy9M
InChI InChI=1S/C16H23F3O5/c1-8-4-5-10-14(3,11(20)16(17,18)19)22-12-15(10)9(8)6-7-13(2,21-12)23-24-15/h8-12,20H,4-7H2,1-3H3/t8-,9+,10+,11-,12+,13-,14+,15-/m1/s1
InChIKey UFLWWNUYRKMMTA-IPTDIXAVSA-N
Mol Weight 352.35 g/mol
Molecular Formula C16H23F3O5
Exact Mass 352.149758 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ABY8xr31HjC
Name #12-BETA+13-BETA;MAJOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9S,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENTAD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H23F3O5
InChI InChI=1S/C16H23F3O5/c1-8-4-5-10-14(3,11(20)16(17,18)19)22-12-15(10)9(8)6-7-13(2,21-12)23-24-15/h8-12,20H,4-7H2,1-3H3/t8-,9+,10+,11-,12+,13-,14+,15-/m1/s1
InChIKey UFLWWNUYRKMMTA-IPTDIXAVSA-N
Literature Reference Author F.GRELLEPOIS,F.CHORKI,B.CROUSSE,M.OUREVITCH,D.B.DELPON,J.P.B EGUE
Literature Reference Citation J.ORG.CHEM.,67,1253(2002)
Literature Reference DOI 10.1021/jo016091f
Solvent CDCl3
Source File Reference UWLU24925