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PARA-TERT.-BUTYLCALIX-[4]-ARENE-BIS-PHOSPHATE

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PARA-TERT.-BUTYLCALIX-[4]-ARENE-BIS-PHOSPHATE
SpectraBase Compound ID 8fbwg7Z621K
InChI InChI=1S/C50H68O9P2/c1-16-54-60(52,55-17-2)57-44-33-19-31-23-39(47(4,5)6)24-32(43(31)51)20-34-26-41(49(10,11)12)28-36-22-38-30-42(50(13,14)15)29-37(21-35(44)27-40(25-33)48(7,8)9)46(38)59-61(53,56-18-3)58-45(34)36/h23-30,51H,16-22H2,1-15H3
InChIKey OVOBMLLTTBDJIF-UHFFFAOYSA-N
Mol Weight 875.0 g/mol
Molecular Formula C50H68O9P2
Exact Mass 874.433858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 58w0sxYvZXF
Name PARA-TERT.-BUTYLCALIX-[4]-ARENE-BIS-PHOSPHATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H68O9P2
InChI InChI=1S/C50H68O9P2/c1-16-54-60(52,55-17-2)57-44-33-19-31-23-39(47(4,5)6)24-32(43(31)51)20-34-26-41(49(10,11)12)28-36-22-38-30-42(50(13,14)15)29-37(21-35(44)27-40(25-33)48(7,8)9)46(38)59-61(53,56-18-3)58-45(34)36/h23-30,51H,16-22H2,1-15H3
InChIKey OVOBMLLTTBDJIF-UHFFFAOYSA-N
Literature Reference Author L.T.BYRNE,J.M.HARROWFIELD,D.C.R.HOCKLESS,B.J.PEACHEY,B.W.SKE LTON,A.H.WHITE
Literature Reference Citation AUSTR.J.CHEM.,46,1673(1993)
Literature Reference DOI 10.1071/ch9931673
Molecular Weight 875.032 g/mol
Solvent Unknown
Source File Reference UWTS4001