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2,3,5,6-Tetrakis(4-tert-butylphenyl)cyclohexa-2,5-diene-1,4-dione
SpectraBase Compound ID 9gqTWvxEhuO
InChI InChI=1S/C46H52O2/c1-43(2,3)33-21-13-29(14-22-33)37-38(30-15-23-34(24-16-30)44(4,5)6)42(48)40(32-19-27-36(28-20-32)46(10,11)12)39(41(37)47)31-17-25-35(26-18-31)45(7,8)9/h13-28H,1-12H3
InChIKey GFJFEIROAXHPCT-UHFFFAOYSA-N
Mol Weight 636.9 g/mol
Molecular Formula C46H52O2
Exact Mass 636.396731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLDmt1dZGOp
Name 2,3,5,6-Tetrakis(4-tert-butylphenyl)cyclohexa-2,5-diene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H52O2
InChI InChI=1S/C46H52O2/c1-43(2,3)33-21-13-29(14-22-33)37-38(30-15-23-34(24-16-30)44(4,5)6)42(48)40(32-19-27-36(28-20-32)46(10,11)12)39(41(37)47)31-17-25-35(26-18-31)45(7,8)9/h13-28H,1-12H3
InChIKey GFJFEIROAXHPCT-UHFFFAOYSA-N
Molecular Weight 636.920 g/mol
SMILES C1(=C(C(=O)C(=C(C1=O)c1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1
SPLASH splash10-052r-8301009000-9f9662f0e48ee7ca87d5
Source of Spectrum F-69-467-3t
Synonyms 4,4''-di-tert-butyl-4',5'-bis(4-(tert-butyl)phenyl)-[1,1':2',1''-terphenyl]-3',6'-dione
Wiley ID 1737440