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(E,2R,6R)-2-TERT.-BUTYL-6-METHYL-5-(PARA-TRIFLUOROMETHYLBENZYLIDEN)-1,3-DIOXAN-4-ONE
SpectraBase Compound ID B57GSFG8qbs
InChI InChI=1S/C17H19F3O3/c1-10-13(14(21)23-15(22-10)16(2,3)4)9-11-5-7-12(8-6-11)17(18,19)20/h5-10,15H,1-4H3/b13-9+/t10-,15-/m1/s1
InChIKey PUZZWUHMABKFKR-GOMWMOKBSA-N
Mol Weight 328.33 g/mol
Molecular Formula C17H19F3O3
Exact Mass 328.128629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4uhoIDuekHD
Name (E,2R,6R)-2-TERT.-BUTYL-6-METHYL-5-(PARA-TRIFLUOROMETHYLBENZYLIDEN)-1,3-DIOXAN-4-ONE
CAS Registry Number 129287-52-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H19F3O3
InChI InChI=1S/C17H19F3O3/c1-10-13(14(21)23-15(22-10)16(2,3)4)9-11-5-7-12(8-6-11)17(18,19)20/h5-10,15H,1-4H3/b13-9+/t10-,15-/m1/s1
InChIKey PUZZWUHMABKFKR-GOMWMOKBSA-N
Literature Reference Author W.AMBERG,D.SEEBACH
Literature Reference Citation CHEM.BER.,123,2413(1990)
Literature Reference DOI 10.1002/cber.19901231225
Molecular Weight 328.331 g/mol
Solvent CDCl3
Source File Reference UWED12720