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Methyl[2-(2,4,8,10-tetra-tert-butyl-dibenzo[D,F][1,3,2]dioxaphosphepin-6-yl-6-oxy)ethyl](2,4,8,10-tetra-tert-butyl-dibenzo[D,E][1,3,2]dioxaphosphepin-6-yl)amine
SpectraBase Compound ID 8imce2SfNqT
InChI InChI=1S/C59H87NO5P2/c1-52(2,3)36-28-40-41-29-37(53(4,5)6)33-45(57(16,17)18)49(41)63-66(62-48(40)44(32-36)56(13,14)15)60(25)26-27-61-67-64-50-42(30-38(54(7,8)9)34-46(50)58(19,20)21)43-31-39(55(10,11)12)35-47(51(43)65-67)59(22,23)24/h28-35H,26-27H2,1-25H3
InChIKey LJVHWUZBKRJGQV-UHFFFAOYSA-N
Mol Weight 952.3 g/mol
Molecular Formula C59H87NO5P2
Exact Mass 951.605949 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID oY6ghGUDIW
Name Methyl[2-(2,4,8,10-tetra-tert-butyl-dibenzo[D,F][1,3,2]dioxaphosphepin-6-yl-6-oxy)ethyl](2,4,8,10-tetra-tert-butyl-dibenzo[D,E][1,3,2]dioxaphosphepin-6-yl)amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 951.605948896 u
Formula C59H87NO5P2
InChI InChI=1S/C59H87NO5P2/c1-52(2,3)36-28-40-41-29-37(53(4,5)6)33-45(57(16,17)18)49(41)63-66(62-48(40)44(32-36)56(13,14)15)60(25)26-27-61-67-64-50-42(30-38(54(7,8)9)34-46(50)58(19,20)21)43-31-39(55(10,11)12)35-47(51(43)65-67)59(22,23)24/h28-35H,26-27H2,1-25H3
InChIKey LJVHWUZBKRJGQV-UHFFFAOYSA-N
Molecular Weight 952.295 g/mol
SMILES c1-2c(OP(Oc3c2cc(cc3C(C)(C)C)C(C)(C)C)OCCN(P2Oc3c(-c4c(O2)c(cc(c4)C(C)(C)C)C(C)(C)C)cc(cc3C(C)(C)C)C(C)(C)C)C)c(cc(c1)C(C)(C)C)C(C)(C)C