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O-{1-[4-DELTA2-3-(2,4,6-TRIMETHYLPHENYL)-5-OXO-1,2,4-OXADIAZOLYL]-1-PHENYL-2,2,2-TRIFLUOROETHYL}-2,4,6-TRIMETHYLPHENYLHYDROXAMIC ACID,CHLOROANHYDRIDE
SpectraBase Compound ID 3moieuCrmM
InChI InChI=1S/C29H27ClF3N3O3/c1-16-12-18(3)23(19(4)13-16)25(30)34-39-28(29(31,32)33,22-10-8-7-9-11-22)36-26(35-38-27(36)37)24-20(5)14-17(2)15-21(24)6/h7-15H,1-6H3/b34-25-
InChIKey NRRBBQATIFVCLX-NQUVTRGKSA-N
Mol Weight 558.0 g/mol
Molecular Formula C29H27ClF3N3O3
Exact Mass 557.169304 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7E8TfXUZX6X
Name O-{1-[4-DELTA2-3-(2,4,6-TRIMETHYLPHENYL)-5-OXO-1,2,4-OXADIAZOLYL]-1-PHENYL-2,2,2-TRIFLUOROETHYL}-2,4,6-TRIMETHYLPHENYLHYDROXAMIC ACID,CHLOROANHYDRIDE
Comments SCALE INVERTED;WP-200 (BRUKER)
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C29H27ClF3N3O3
InChI InChI=1S/C29H27ClF3N3O3/c1-16-12-18(3)23(19(4)13-16)25(30)34-39-28(29(31,32)33,22-10-8-7-9-11-22)36-26(35-38-27(36)37)24-20(5)14-17(2)15-21(24)6/h7-15H,1-6H3/b34-25-
InChIKey NRRBBQATIFVCLX-NQUVTRGKSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, V.V.PIROZHENKO, V.N.FETYUKHIN, A.A.ESIPENKO, E.A.ROMANENKO,L.I.SAMARAI (1990) Ukrain.Khim.Zhurn.(Russ. Lang.): v.56, N3, 276-280.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d