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37-[(DIETHOXYPHOSPHORYL)-OXY]-5,11,17,23,29,35-HEXAKIS-(1,1-DIMETHYLETHYL)-CALIX-[6]-ARENE-38,39,40,41,42-PENTOL
SpectraBase Compound ID 172GtzfZva
InChI InChI=1S/C70H93O9P/c1-21-77-80(76,78-22-2)79-64-51-27-49-37-56(68(12,13)14)35-47(62(49)74)25-45-33-54(66(6,7)8)31-43(60(45)72)23-41-29-53(65(3,4)5)30-42(59(41)71)24-44-32-55(67(9,10)11)34-46(61(44)73)26-48-36-57(69(15,16)17)38-50(63(48)75)28-52(64)40-58(39-51)70(18,19)20/h29-40,71-75H,21-28H2,1-20H3
InChIKey QPKIULNYZWKNAS-UHFFFAOYSA-N
Mol Weight 1109.5 g/mol
Molecular Formula C70H93O9P
Exact Mass 1108.655722 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B1IW4quibXm
Name 37-[(DIETHOXYPHOSPHORYL)-OXY]-5,11,17,23,29,35-HEXAKIS-(1,1-DIMETHYLETHYL)-CALIX-[6]-ARENE-38,39,40,41,42-PENTOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C70H93O9P
InChI InChI=1S/C70H93O9P/c1-21-77-80(76,78-22-2)79-64-51-27-49-37-56(68(12,13)14)35-47(62(49)74)25-45-33-54(66(6,7)8)31-43(60(45)72)23-41-29-53(65(3,4)5)30-42(59(41)71)24-44-32-55(67(9,10)11)34-46(61(44)73)26-48-36-57(69(15,16)17)38-50(63(48)75)28-52(64)40-58(39-51)70(18,19)20/h29-40,71-75H,21-28H2,1-20H3
InChIKey QPKIULNYZWKNAS-UHFFFAOYSA-N
Literature Reference Author R.G.JANSSEN,J.P.M.V.DUYNHOVEN,W.VERBOOM,G.J.V.HUMMEL,S.HARKE MA,D.N.REINHOUDT
Literature Reference Citation J.AM.CHEM.SOC.,118,3666(1996)
Literature Reference DOI 10.1021/ja9540942
Solvent CDCl3
Source File Reference UWSI37741