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2,4,8,10-TETRA-TERT-BUTYL-6-[2',4'-DI-TERT-BUTYL-6'-(2-HYDROXY-3,5-DI-TERT-BUTYLPHENYLMETHYL)PHENOXY]-12H-DIBENZO[D,G][1,3,2]DIOXAPHOSPHOCIN

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2,4,8,10-TETRA-TERT-BUTYL-6-[2',4'-DI-TERT-BUTYL-6'-(2-HYDROXY-3,5-DI-TERT-BUTYLPHENYLMETHYL)PHENOXY]-12H-DIBENZO[D,G][1,3,2]DIOXAPHOSPHOCIN
SpectraBase Compound ID 5x14kyr1tq6
InChI InChI=1S/C59H87O4P/c1-35-42-29-40(54(8,9)10)33-46(58(20,21)22)50(42)62-64(63-51-43(35)30-41(55(11,12)13)34-47(51)59(23,24)25)61-49-37(28-39(53(5,6)7)32-45(49)57(17,18)19)26-36-27-38(52(2,3)4)31-44(48(36)60)56(14,15)16/h27-35,60H,26H2,1-25H3
InChIKey DRRHVBMCROPTIJ-UHFFFAOYSA-N
Mol Weight 891.3 g/mol
Molecular Formula C59H87O4P
Exact Mass 890.634198 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8oU5Xg5xMvD
Name 2,4,8,10-TETRA-TERT-BUTYL-6-[2',4'-DI-TERT-BUTYL-6'-(2-HYDROXY-3,5-DI-TERT-BUTYLPHENYLMETHYL)PHENOXY]-12H-DIBENZO[D,G][1,3,2]DIOXAPHOSPHOCIN
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C59H87O4P
InChI InChI=1S/C59H87O4P/c1-35-42-29-40(54(8,9)10)33-46(58(20,21)22)50(42)62-64(63-51-43(35)30-41(55(11,12)13)34-47(51)59(23,24)25)61-49-37(28-39(53(5,6)7)32-45(49)57(17,18)19)26-36-27-38(52(2,3)4)31-44(48(36)60)56(14,15)16/h27-35,60H,26H2,1-25H3
InChIKey DRRHVBMCROPTIJ-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference P.A.ODORISIO, S.D.PASTOR, J.D.SPIVACK (1984) Phosphorus and Sulfur: v.19, N1, 1-10.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C6D6 benzene-d6