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DIISOPROPYL-[2-ACETYLAMINO-1-BROMO-2-(4'-N,N-DIMETHYLAMINOPHENYL)-ETHYL]-PHOSPHONATE
SpectraBase Compound ID KwgbKC3xBhc
InChI InChI=1S/2C18H30BrN2O4P/c2*1-12(2)24-26(23,25-13(3)4)18(19)17(20-14(5)22)15-8-10-16(11-9-15)21(6)7/h2*8-13,17-18H,1-7H3,(H,20,22)
InChIKey XDJZJCGBRKTKLG-UHFFFAOYSA-N
Mol Weight 898.65 g/mol
Molecular Formula C36H60Br2N4O8P2
Exact Mass 896.225315 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G3XmjrRt75k
Name DIISOPROPYL-[2-ACETYLAMINO-1-BROMO-2-(4'-N,N-DIMETHYLAMINOPHENYL)-ETHYL]-PHOSPHONATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H60Br2N4O8P2
InChI InChI=1S/2C18H30BrN2O4P/c2*1-12(2)24-26(23,25-13(3)4)18(19)17(20-14(5)22)15-8-10-16(11-9-15)21(6)7/h2*8-13,17-18H,1-7H3,(H,20,22)
InChIKey XDJZJCGBRKTKLG-UHFFFAOYSA-N
Literature Reference Author X.QI,S.H.LEE,J.Y.KWON,Y.KIM,S.J.KIM,Y.S.LEE,J.YOON
Literature Reference Citation J.ORG.CHEM.,68,9140(2003)
Literature Reference DOI 10.1021/jo034535x
Molecular Weight 898.650 g/mol
Solvent CDCl3
Source File Reference UWSI22553