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1-{2'-Methyl-5'-[3'',5''-di(T-butyl)-4''-hydroxyphenyl]styryl}-2-[4'-(3'',5''-di(T-butyl)-4''-hydroxyphenyl]styryl}-benzene
SpectraBase Compound ID 8W7hNE57SOP
InChI InChI=1S/C51H60O2/c1-33-17-25-39(41-31-44(50(8,9)10)47(53)45(32-41)51(11,12)13)28-37(33)26-24-35-20-18-34(19-21-35)22-23-36-15-14-16-38(27-36)40-29-42(48(2,3)4)46(52)43(30-40)49(5,6)7/h14-32,52-53H,1-13H3/b23-22+,26-24+
InChIKey HIYNSTTXNKMBEC-UEZPFBRLSA-N
Mol Weight 705.0 g/mol
Molecular Formula C51H60O2
Exact Mass 704.459331 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8sw7ZyqBlJB
Name 1-{2'-Methyl-5'-[3'',5''-di(T-butyl)-4''-hydroxyphenyl]styryl}-2-[4'-(3'',5''-di(T-butyl)-4''-hydroxyphenyl]styryl}-benzene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 704.459331170 u
Formula C51H60O2
InChI InChI=1S/C51H60O2/c1-33-17-25-39(41-31-44(50(8,9)10)47(53)45(32-41)51(11,12)13)28-37(33)26-24-35-20-18-34(19-21-35)22-23-36-15-14-16-38(27-36)40-29-42(48(2,3)4)46(52)43(30-40)49(5,6)7/h14-32,52-53H,1-13H3/b23-22+,26-24+
InChIKey HIYNSTTXNKMBEC-UEZPFBRLSA-N
SMILES C1(=C(C(C(C)(C)C)=CC(=C1)C1=CC(\C=C\C2=CC=C(\C=C\C3=CC(C4=CC(=C(O)C(=C4)C(C)(C)C)C(C)(C)C)=CC=C3)C=C2)=C(C)C=C1)O)C(C)(C)C