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#8B;(+/-)-(3A-A,6-A,7-B,7A-B,7B-A)-7-(2-CHLORO-6-FLUOROPHENYL)-N,N-DIETHYLOCTAHYDRO-6-METHYL-1,3-DIOXO-2-PHENYLAZETO-[1,2-B]-PYRROLO-[3,4-D]-ISOXAZOL-6-CARBOXA

Compound with spectra: 1 NMR

#8B;(+/-)-(3A-A,6-A,7-B,7A-B,7B-A)-7-(2-CHLORO-6-FLUOROPHENYL)-N,N-DIETHYLOCTAHYDRO-6-METHYL-1,3-DIOXO-2-PHENYLAZETO-[1,2-B]-PYRROLO-[3,4-D]-ISOXAZOL-6-CARBOXA
SpectraBase Compound ID ESms9NlYBTE
InChI InChI=1S/C25H25ClFN3O4/c1-4-28(5-2)24(33)25(3)19(17-15(26)12-9-13-16(17)27)20-18-21(34-30(20)25)23(32)29(22(18)31)14-10-7-6-8-11-14/h6-13,18-21H,4-5H2,1-3H3/t18-,19+,20+,21+,25+/m0/s1
InChIKey FWNMDVWTALGNLL-JREFGXEFSA-N
Mol Weight 485.94 g/mol
Molecular Formula C25H25ClFN3O4
Exact Mass 485.151762 g/mol
Enantiomer InChIKey FWNMDVWTALGNLL-PHGOAHNDSA-N

View Spectrum of #8B;(+/-)-(3A-A,6-A,7-B,7A-B,7B-A)-7-(2-CHLORO-6-FLUOROPHENYL)-N,N-DIETHYLOCTAHYDRO-6-METHYL-1,3-DIOXO-2-PHENYLAZETO-[1,2-B]-PYRROLO-[3,4-D]-ISOXAZOL-6-CARBOXA

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
(.+-.)-(3a-A,6-A,7-B,7a-B,7b-A)-7-(2-Chloro-6-fluorophenyl)-N,N-diethyloctahydro-6-methyl-1,3-dioxo-2-phenylazeto-[1,2-B-
Title Journal or Book Year
Reactivity of four-membered cyclic nitrones in 1,3-cycloaddition reactions. X-Ray crystal structure of 7-(2,6-dichlorophenyl)-N,N-diethyloctahydro-6-methyl-1,3-dioxo-2-phenylazeto[1,2-b]pyrrolo[3,4-d]isoxazole-6-carboxamide Recueil des Travaux Chimiques des Pays-Bas 2010
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