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#9B;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-(PARA-TOLYL)-
SpectraBase Compound ID BH7riAHXFUe
InChI InChI=1S/C26H29N8O7P/c1-18-2-4-20(5-3-18)28-26(35)30-42(38)40-15-19-13-27-33(24(19)16-41-42)14-25-29-22-7-6-21(34(36)37)12-23(22)32(25)17-31-8-10-39-11-9-31/h2-7,12-13H,8-11,14-17H2,1H3,(H2,28,30,35,38)
InChIKey YQFXYSPWTXGWHB-UHFFFAOYSA-N
Mol Weight 596.54 g/mol
Molecular Formula C26H29N8O7P
Exact Mass 596.189682 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JIdx4BKZzOV
Name #9B;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-(PARA-TOLYL)-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H29N8O7P
InChI InChI=1S/C26H29N8O7P/c1-18-2-4-20(5-3-18)28-26(35)30-42(38)40-15-19-13-27-33(24(19)16-41-42)14-25-29-22-7-6-21(34(36)37)12-23(22)32(25)17-31-8-10-39-11-9-31/h2-7,12-13H,8-11,14-17H2,1H3,(H2,28,30,35,38)
InChIKey YQFXYSPWTXGWHB-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 596.539 g/mol
Solvent DMSO-D6
Source File Reference UWBT13746