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2,5-Bis(6-tert-butyl-7,7-dimethylocta-1,3,5-trienyl)thiophene
SpectraBase Compound ID DUAtvJuAMVU
InChI InChI=1S/C32H48S/c1-29(2,3)27(30(4,5)6)21-17-13-15-19-25-23-24-26(33-25)20-16-14-18-22-28(31(7,8)9)32(10,11)12/h13-24H,1-12H3/b17-13+,18-14+,19-15+,20-16+
InChIKey QNPZIACQOYQJNB-AQWWNALJSA-N
Mol Weight 464.8 g/mol
Molecular Formula C32H48S
Exact Mass 464.347673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Gfzf2mZ0q
Name 2,5-Bis(6-tert-butyl-7,7-dimethylocta-1,3,5-trienyl)thiophene
Alternate Name(s) 2,5-bis[(1E,3E)-6-tert-butyl-7,7-dimethylocta-1,3,5-trienyl]thiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H48S
InChI InChI=1S/C32H48S/c1-29(2,3)27(30(4,5)6)21-17-13-15-19-25-23-24-26(33-25)20-16-14-18-22-28(31(7,8)9)32(10,11)12/h13-24H,1-12H3/b17-13+,18-14+,19-15+,20-16+
InChIKey QNPZIACQOYQJNB-AQWWNALJSA-N
Molecular Weight 464.796 g/mol
SMILES C(C(C)(C)C)(C(C)(C)C)=C\C=C\C=C\c1sc(\C=C\C=C\C=C(C(C)(C)C)C(C)(C)C)cc1
SPLASH splash10-006t-5390100000-76a744f2f5902e63a0d1
Source of Spectrum U1-2010-4043-29
Wiley ID 1664066