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9,9-Dimethyl-4-(4'-methylphenyl)-2,2,6,6-tetra(2'-naphthyl)-3,5,8,10-tetraoxa-4-phosphabicyclo[5.3.0]decane
SpectraBase Compound ID BrLXGktKr9I
InChI InChI=1S/C54H43O4P/c1-36-20-30-49(31-21-36)59-57-53(45-26-22-37-12-4-8-16-41(37)32-45,46-27-23-38-13-5-9-17-42(38)33-46)50-51(56-52(2,3)55-50)54(58-59,47-28-24-39-14-6-10-18-43(39)34-47)48-29-25-40-15-7-11-19-44(40)35-48/h4-35,50-51H,1-3H3/t50-,51-/m1/s1
InChIKey KUVRFSAETSOVDC-IKLFXBHTSA-N
Mol Weight 786.9 g/mol
Molecular Formula C54H43O4P
Exact Mass 786.289897 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AG2OlR2VF8x
Name 9,9-Dimethyl-4-(4'-methylphenyl)-2,2,6,6-tetra(2'-naphthyl)-3,5,8,10-tetraoxa-4-phosphabicyclo[5.3.0]decane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C54H43O4P
InChI InChI=1S/C54H43O4P/c1-36-20-30-49(31-21-36)59-57-53(45-26-22-37-12-4-8-16-41(37)32-45,46-27-23-38-13-5-9-17-42(38)33-46)50-51(56-52(2,3)55-50)54(58-59,47-28-24-39-14-6-10-18-43(39)34-47)48-29-25-40-15-7-11-19-44(40)35-48/h4-35,50-51H,1-3H3/t50-,51-/m1/s1
InChIKey KUVRFSAETSOVDC-IKLFXBHTSA-N
Molecular Weight 786.908 g/mol
SMILES C1([C@]2([C@](C(c3cc4ccccc4cc3)(c3cc4ccccc4cc3)OP(O1)c1ccc(cc1)C)(OC(O2)(C)C)[H])[H])(c1cc2ccccc2cc1)c1cc2ccccc2cc1
SPLASH splash10-014i-0092011000-8ba04e2209d6e640d438
Source of Spectrum H-76-2662-3
Synonyms (3aR,8aR)-2,2-Dimethyl-4,4,8,8-tetra-naphthalen-2-yl-6-p-tolyl-tetrahydro-[1,3]dioxolo[4,5-e][1,3,2]dioxaphosphepine 2,2-Dimethyl-6-(4-methylphenyl)-4,4,8,8-tetra(2-naphthyl)tetrahydro[1,3]dioxolo[4,5-e][1,3,2]dioxaphosphepin
Wiley ID 1416979