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1,4-bis(4-tert-butylphenyl)-2,3-bis[(4-tert-butylphenyl)-oxomethyl]-2-butene-1,4-dione

View entire compound with spectra: 1 MS (GC)

1,4-bis(4-tert-butylphenyl)-2,3-bis[(4-tert-butylphenyl)-oxomethyl]-2-butene-1,4-dione
SpectraBase Compound ID D48mzH6HV44
InChI InChI=1S/C46H52O4/c1-43(2,3)33-21-13-29(14-22-33)39(47)37(40(48)30-15-23-34(24-16-30)44(4,5)6)38(41(49)31-17-25-35(26-18-31)45(7,8)9)42(50)32-19-27-36(28-20-32)46(10,11)12/h13-28H,1-12H3
InChIKey VBNWARHJLIPQNA-UHFFFAOYSA-N
Mol Weight 668.9 g/mol
Molecular Formula C46H52O4
Exact Mass 668.38656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0WQkwPIkit
Name 1,4-bis(4-tert-butylphenyl)-2,3-bis[(4-tert-butylphenyl)-oxomethyl]-2-butene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H52O4
InChI InChI=1S/C46H52O4/c1-43(2,3)33-21-13-29(14-22-33)39(47)37(40(48)30-15-23-34(24-16-30)44(4,5)6)38(41(49)31-17-25-35(26-18-31)45(7,8)9)42(50)32-19-27-36(28-20-32)46(10,11)12/h13-28H,1-12H3
InChIKey VBNWARHJLIPQNA-UHFFFAOYSA-N
Molecular Weight 668.918 g/mol
SMILES C(=C(C(c1ccc(C(C)(C)C)cc1)=O)C(c1ccc(C(C)(C)C)cc1)=O)(C(c1ccc(C(C)(C)C)cc1)=O)C(c1ccc(C(C)(C)C)cc1)=O
SPLASH splash10-014i-0900225000-98d09de30e9526e2f08c
Source of Spectrum O1-36-1159-2
Synonyms 1,4-bis(4-tert-butylphenyl)-2,3-bis[(4-tert-butylphenyl)carbonyl]but-2-ene-1,4-dione 2,3-bis(4-tert-butylbenzoyl)-1,4-bis(4-tert-butylphenyl)but-2-ene-1,4-dione
Wiley ID 819784