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1-[2-(4-CHLOROPHENYL)-5-[2-(4-NITROPHENOXY)-1,3,2-BENZODIOXA-PHOSPHOLE-4-YL-2-OXIDE]-2-METHYL-1,3,4-OXADIAZOLE-3(2H)-YL]-ETHANONE

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1-[2-(4-CHLOROPHENYL)-5-[2-(4-NITROPHENOXY)-1,3,2-BENZODIOXA-PHOSPHOLE-4-YL-2-OXIDE]-2-METHYL-1,3,4-OXADIAZOLE-3(2H)-YL]-ETHANONE
SpectraBase Compound ID FNuVxx4NV1V
InChI InChI=1S/C23H17ClN3O8P/c1-14(28)26-23(2,15-6-8-16(24)9-7-15)32-22(25-26)19-4-3-5-20-21(19)35-36(31,34-20)33-18-12-10-17(11-13-18)27(29)30/h3-13H,1-2H3
InChIKey CRSJHIOGPSDCQP-UHFFFAOYSA-N
Mol Weight 529.83 g/mol
Molecular Formula C23H17ClN3O8P
Exact Mass 529.044179 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HsnV0zPMYSz
Name 1-[2-(4-CHLOROPHENYL)-5-[2-(4-NITROPHENOXY)-1,3,2-BENZODIOXA-PHOSPHOLE-4-YL-2-OXIDE]-2-METHYL-1,3,4-OXADIAZOLE-3(2H)-YL]-ETHANONE
Compound Number 6J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H17ClN3O8P
InChI InChI=1S/C23H17ClN3O8P/c1-14(28)26-23(2,15-6-8-16(24)9-7-15)32-22(25-26)19-4-3-5-20-21(19)35-36(31,34-20)33-18-12-10-17(11-13-18)27(29)30/h3-13H,1-2H3
InChIKey CRSJHIOGPSDCQP-UHFFFAOYSA-N
Literature Reference Author P.J.RAO,K.S.B.AISHWARYA,Y.N.SPOORTHY,D.I.BEGUM,L.K.RAVINDRAN ATH
Literature Reference Citation D.PHARM.SINICA,3,653(2012)
Molecular Weight 529.830 g/mol
Solvent DMSO-D6
Source File Reference UWLU78045