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1,2,3,4,5-Pentakis(4-tert-butylphenyl)benzene
SpectraBase Compound ID IhxrJQvXt1K
InChI InChI=1S/C56H66/c1-52(2,3)42-26-16-37(17-27-42)47-36-48(38-18-28-43(29-19-38)53(4,5)6)50(40-22-32-45(33-23-40)55(10,11)12)51(41-24-34-46(35-25-41)56(13,14)15)49(47)39-20-30-44(31-21-39)54(7,8)9/h16-36H,1-15H3
InChIKey VZHQLMFXDDHDCM-UHFFFAOYSA-N
Mol Weight 739.1 g/mol
Molecular Formula C56H66
Exact Mass 738.516452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xlu8tbZipc
Name 1,2,3,4,5-Pentakis(4-tert-butylphenyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C56H66
InChI InChI=1S/C56H66/c1-52(2,3)42-26-16-37(17-27-42)47-36-48(38-18-28-43(29-19-38)53(4,5)6)50(40-22-32-45(33-23-40)55(10,11)12)51(41-24-34-46(35-25-41)56(13,14)15)49(47)39-20-30-44(31-21-39)54(7,8)9/h16-36H,1-15H3
InChIKey VZHQLMFXDDHDCM-UHFFFAOYSA-N
Molecular Weight 739.144 g/mol
SMILES c1(c(c(c(c(c1)-c1ccc(cc1)C(C)(C)C)-c1ccc(cc1)C(C)(C)C)-c1ccc(cc1)C(C)(C)C)-c1ccc(cc1)C(C)(C)C)-c1ccc(cc1)C(C)(C)C
SPLASH splash10-000i-0000000900-ec3cd112db9323e15d45
Source of Spectrum F-72-1089-2d
Synonyms 4,4''-di-tert-butyl-3',4',5'-tris(4-(tert-butyl)phenyl)-1,1':2',1''-terphenyl
Wiley ID 1806107