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N-(2,4-DIMETHYLPHENYL)-N'-(2,3-DIHYDRO-2-OXIDO-5-BENZOYL-1H-1,3,2-BENZODIAZAPHOSPHOL-2-YL)-UREA
SpectraBase Compound ID 8NmA3zUAxch
InChI InChI=1S/2C22H21N4O3P/c2*1-14-8-10-18(15(2)12-14)23-22(28)26-30(29)24-19-11-9-17(13-20(19)25-30)21(27)16-6-4-3-5-7-16/h2*3-13H,1-2H3,(H4,23,24,25,26,28,29)
InChIKey SYKSIIAYIXTYSD-UHFFFAOYSA-N
Mol Weight 840.82 g/mol
Molecular Formula C44H42N8O6P2
Exact Mass 840.270255 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CiTWcVdl4r0
Name N-(2,4-DIMETHYLPHENYL)-N'-(2,3-DIHYDRO-2-OXIDO-5-BENZOYL-1H-1,3,2-BENZODIAZAPHOSPHOL-2-YL)-UREA
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H42N8O6P2
InChI InChI=1S/2C22H21N4O3P/c2*1-14-8-10-18(15(2)12-14)23-22(28)26-30(29)24-19-11-9-17(13-20(19)25-30)21(27)16-6-4-3-5-7-16/h2*3-13H,1-2H3,(H4,23,24,25,26,28,29)
InChIKey SYKSIIAYIXTYSD-UHFFFAOYSA-N
Literature Reference Author P.V.G.REDDY,C.S.REDDY,C.N.RAJU
Literature Reference Citation CHEM.PHARM.BULL.,51,860(2003)
Literature Reference DOI 10.1248/cpb.51.860
Molecular Weight 840.815 g/mol
Solvent DMSO-D6
Source File Reference UWLU20078