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#1;17,17,40,40-TETRAMETHYL-1,10,24,33-TETRAOXY-[2]-(2,6)-PYRIDINO-[2,1]-PARACYCLO-[2]-(2,6)-PYRIDINO-[2,1]-PARACYCLOPHANE-12,20,35,43-TETRAPHOSPHONIC-ACID-TETR
SpectraBase Compound ID KNYb5l0Grt1
InChI InChI=1S/C52H62N2O16P4.4Li/c1-9-67-71(55,56)47-27-35-19-23-43(47)63-31-39-15-13-16-40(53-39)32-64-45-25-21-37(29-49(45)73(59,60)69-11-3)52(7,8)38-22-26-46(50(30-38)74(61,62)70-12-4)66-34-42-18-14-17-41(54-42)33-65-44-24-20-36(51(35,5)6)28-48(44)72(57,58)68-10-2;;;;/h13-30H,9-12,31-34H2,1-8H3,(H,55,56)(H,57,58)(H,59,60)(H,61,62);;;;/q;4*+1/p-4
InChIKey XYMSEKSOQNKXSF-UHFFFAOYSA-J
Mol Weight 1118.69 g/mol
Molecular Formula C52H58Li4N2O16P4
Exact Mass 1118.337696 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DpxOnKUirjn
Name #1;17,17,40,40-TETRAMETHYL-1,10,24,33-TETRAOXY-[2]-(2,6)-PYRIDINO-[2,1]-PARACYCLO-[2]-(2,6)-PYRIDINO-[2,1]-PARACYCLOPHANE-12,20,35,43-TETRAPHOSPHONIC-ACID-TETR
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H58Li4N2O16P4
InChI InChI=1S/C52H62N2O16P4.4Li/c1-9-67-71(55,56)47-27-35-19-23-43(47)63-31-39-15-13-16-40(53-39)32-64-45-25-21-37(29-49(45)73(59,60)69-11-3)52(7,8)38-22-26-46(50(30-38)74(61,62)70-12-4)66-34-42-18-14-17-41(54-42)33-65-44-24-20-36(51(35,5)6)28-48(44)72(57,58)68-10-2;;;;/h13-30H,9-12,31-34H2,1-8H3,(H,55,56)(H,57,58)(H,59,60)(H,61,62);;;;/q;4*+1/p-4
InChIKey XYMSEKSOQNKXSF-UHFFFAOYSA-J
Literature Reference Author T.GRAWE,T.SCHRADER,P.FINOCCHIARO,G.CONSUGLIO,S.FAILLA
Literature Reference Citation ORG.LETTERS,3,1597(2001)
Literature Reference DOI 10.1021/ol015668c
Solvent CD3OD
Source File Reference UWLU33825