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(4R,5R)-N'4,N'5-BIS-[2-OXO-1-(PIPERIDIN-1-YL-METHYL)-INDOLIN-3-YLIDENE]-2-(4-METHYLPHENOXY)-1,3,2-DIOXA-PHOSPHOLANE-4,5-DICARBOHYDRAZIDE-2-OXIDE
SpectraBase Compound ID GDnhOqVAAB1
InChI InChI=1S/C39H43N8O8P/c1-26-16-18-27(19-17-26)53-56(52)54-34(36(48)42-40-32-28-12-4-6-14-30(28)46(38(32)50)24-44-20-8-2-9-21-44)35(55-56)37(49)43-41-33-29-13-5-7-15-31(29)47(39(33)51)25-45-22-10-3-11-23-45/h4-7,12-19,34-35H,2-3,8-11,20-25H2,1H3,(H,42,48)(H,43,49)/b40-32-,41-33-/t34-,35-/m1/s1
InChIKey MTLZRJULNFETNG-NCQCUBNOSA-N
Mol Weight 782.8 g/mol
Molecular Formula C39H43N8O8P
Exact Mass 782.294147 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 897c2ELbxia
Name (4R,5R)-N'4,N'5-BIS-[2-OXO-1-(PIPERIDIN-1-YL-METHYL)-INDOLIN-3-YLIDENE]-2-(4-METHYLPHENOXY)-1,3,2-DIOXA-PHOSPHOLANE-4,5-DICARBOHYDRAZIDE-2-OXIDE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H43N8O8P
InChI InChI=1S/C39H43N8O8P/c1-26-16-18-27(19-17-26)53-56(52)54-34(36(48)42-40-32-28-12-4-6-14-30(28)46(38(32)50)24-44-20-8-2-9-21-44)35(55-56)37(49)43-41-33-29-13-5-7-15-31(29)47(39(33)51)25-45-22-10-3-11-23-45/h4-7,12-19,34-35H,2-3,8-11,20-25H2,1H3,(H,42,48)(H,43,49)/b40-32-,41-33-/t34-,35-/m1/s1
InChIKey MTLZRJULNFETNG-NCQCUBNOSA-N
Literature Reference Author K.S.B.AISWARYA,P.J.RAO,Y.N.SPOORTHY,D.I.BEGUM,L.K.RAVINDRANA TH
Literature Reference Citation J.CHEM.PHARM.RES.,4,8,4052(2012)
Solvent DMSO-D6
Source File Reference UWIR14079