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#9A;1-[[1-[(1-MORPHOLINOMETHYL)-6-NITRO-1H-BENZO-[D]-IMIDAZOL-2-YL]-METHYL]-6-OXIDO-4,8-DIHYDRO-1H-[1,3,2]-DIOXAPHOSPHENO-[5,6-C]-PYRAZOL-6-YL]-3-PHENYLUREA

View entire compound with spectra: 2 NMR

#9A;1-[[1-[(1-MORPHOLINOMETHYL)-6-NITRO-1H-BENZO-[D]-IMIDAZOL-2-YL]-METHYL]-6-OXIDO-4,8-DIHYDRO-1H-[1,3,2]-DIOXAPHOSPHENO-[5,6-C]-PYRAZOL-6-YL]-3-PHENYLUREA
SpectraBase Compound ID 4gcDKSpnc8k
InChI InChI=1S/C25H27N8O7P/c34-25(27-19-4-2-1-3-5-19)29-41(37)39-15-18-13-26-32(23(18)16-40-41)14-24-28-21-7-6-20(33(35)36)12-22(21)31(24)17-30-8-10-38-11-9-30/h1-7,12-13H,8-11,14-17H2,(H2,27,29,34,37)
InChIKey JLBUJZURPVMJRP-UHFFFAOYSA-N
Mol Weight 582.51 g/mol
Molecular Formula C25H27N8O7P
Exact Mass 582.174032 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AMu4WQZgmDi
Name #9A;1-[[1-[(1-MORPHOLINOMETHYL)-6-NITRO-1H-BENZO-[D]-IMIDAZOL-2-YL]-METHYL]-6-OXIDO-4,8-DIHYDRO-1H-[1,3,2]-DIOXAPHOSPHENO-[5,6-C]-PYRAZOL-6-YL]-3-PHENYLUREA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H27N8O7P
InChI InChI=1S/C25H27N8O7P/c34-25(27-19-4-2-1-3-5-19)29-41(37)39-15-18-13-26-32(23(18)16-40-41)14-24-28-21-7-6-20(33(35)36)12-22(21)31(24)17-30-8-10-38-11-9-30/h1-7,12-13H,8-11,14-17H2,(H2,27,29,34,37)
InChIKey JLBUJZURPVMJRP-UHFFFAOYSA-N
Literature Reference Author C.H.L.PRAVEENA,V.E.RANI,Y.N.SPOORTHY,L.K.RAVINDRANATH
Literature Reference Citation J.CHEM.PHARM.RES.,5,5,280(2013)
Molecular Weight 582.513 g/mol
Solvent DMSO-D6
Source File Reference UWBT13745