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AYFXEDQMWOTKMS-FANRRYISSA-N
SpectraBase Compound ID 6syNke0mDwm
InChI InChI=1S/C42H45N2O9PS/c1-26-21-27(2)38(28(3)22-26)40(46)53-54(7,55)52-35-23-37(44-24-29(4)39(45)43-41(44)47)51-36(35)25-50-42(30-11-9-8-10-12-30,31-13-17-33(48-5)18-14-31)32-15-19-34(49-6)20-16-32/h8-22,24,35-37H,23,25H2,1-7H3,(H,43,45,47)/t35-,36+,37+,54?/m1/s1
InChIKey AYFXEDQMWOTKMS-FANRRYISSA-N
Mol Weight 784.9 g/mol
Molecular Formula C42H45N2O9PS
Exact Mass 784.258339 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HN7TYV4M076
Name AYFXEDQMWOTKMS-FANRRYISSA-N
Compound Number SLOW_RP-7-(B=T)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H45N2O9PS
InChI InChI=1S/C42H45N2O9PS/c1-26-21-27(2)38(28(3)22-26)40(46)53-54(7,55)52-35-23-37(44-24-29(4)39(45)43-41(44)47)51-36(35)25-50-42(30-11-9-8-10-12-30,31-13-17-33(48-5)18-14-31)32-15-19-34(49-6)20-16-32/h8-22,24,35-37H,23,25H2,1-7H3,(H,43,45,47)/t35-,36+,37+,54?/m1/s1
InChIKey AYFXEDQMWOTKMS-FANRRYISSA-N
Literature Reference Author L.A.WOZNIAK,A.CHWOROS,J.PYZOWSKI,W.J.STEC
Literature Reference Citation J.ORG.CHEM.,63,9109(1998)
Literature Reference DOI 10.1021/jo981304v
Solvent CDCl3
Source File Reference UWMZ27125