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1,4-Bis(2,5-di-tert-butylcyclohexa-2,4-dien-1-yl)butane
SpectraBase Compound ID 4rAjQuWXcyA
InChI InChI=1S/C32H54/c1-29(2,3)25-17-19-27(31(7,8)9)23(21-25)15-13-14-16-24-22-26(30(4,5)6)18-20-28(24)32(10,11)12/h17-20,23-24H,13-16,21-22H2,1-12H3
InChIKey MTOZEIMMAHMSLT-UHFFFAOYSA-N
Mol Weight 438.8 g/mol
Molecular Formula C32H54
Exact Mass 438.422552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6IsySQq1tJ2
Name 1,4-Bis(2,5-di-tert-butylcyclohexa-2,4-dien-1-yl)butane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H54
InChI InChI=1S/C32H54/c1-29(2,3)25-17-19-27(31(7,8)9)23(21-25)15-13-14-16-24-22-26(30(4,5)6)18-20-28(24)32(10,11)12/h17-20,23-24H,13-16,21-22H2,1-12H3
InChIKey MTOZEIMMAHMSLT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo201757w
Molecular Weight 438.784 g/mol
SMILES C=1C=C(C(C)(C)C)C(CC1C(C)(C)C)CCCCC1CC(=CC=C1C(C)(C)C)C(C)(C)C
SPLASH splash10-0a4l-9200000000-85bd34a941d42aea304f
Source of Spectrum J-76-8572-9a
Synonyms 1,4-Ditert-butyl-5-[4-(2,5-ditert-butyl-1-cyclohexa-2,4-dienyl)butyl]cyclohexa-1,3-diene
Wiley ID 1746956