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4-ENDO-ISOPROPYL-7-METHYL-1-(3-OXOBUTYL)-4-EXO-(2,2,2-TRIFLUOROETHOXY)-8-OXABICYCLO-[3.2.1]-OCTAN-3-ONE
SpectraBase Compound ID 5a5pMrCaLrW
InChI InChI=1S/C17H25F3O4/c1-10(2)17(23-9-16(18,19)20)13(22)8-15(6-5-12(4)21)11(3)7-14(17)24-15/h10-11,14H,5-9H2,1-4H3/t11-,14-,15-,17+/m0/s1
InChIKey MMSGVQODLZCXHC-JIRONKKISA-N
Mol Weight 350.38 g/mol
Molecular Formula C17H25F3O4
Exact Mass 350.170494 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E21ZLLDkqV2
Name 4-ENDO-ISOPROPYL-7-METHYL-1-(3-OXOBUTYL)-4-EXO-(2,2,2-TRIFLUOROETHOXY)-8-OXABICYCLO-[3.2.1]-OCTAN-3-ONE
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H25F3O4
InChI InChI=1S/C17H25F3O4/c1-10(2)17(23-9-16(18,19)20)13(22)8-15(6-5-12(4)21)11(3)7-14(17)24-15/h10-11,14H,5-9H2,1-4H3/t11-,14-,15-,17+/m0/s1
InChIKey MMSGVQODLZCXHC-JIRONKKISA-N
Literature Reference Author B.FOEHLISCH,R.FLOGAUS,G.H.HENLE,S.SENDELBACH,S.HENKEL
Literature Reference Citation EUR.J.ORG.CHEM.,2160(2006)
Literature Reference DOI 10.1002/ejoc.200500777
Molecular Weight 350.378 g/mol
Sample ID 46587
Solvent CDCl3