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1,4-bis[(E)-2-(4-tert-butylsulfanylphenyl)vinyl]benzene

View entire compound with spectra: 1 NMR, and 2 MS (GC)

1,4-bis[(E)-2-(4-tert-butylsulfanylphenyl)vinyl]benzene
SpectraBase Compound ID 3qYRVNnXaPI
InChI InChI=1S/C30H34S2/c1-29(2,3)31-27-19-15-25(16-20-27)13-11-23-7-9-24(10-8-23)12-14-26-17-21-28(22-18-26)32-30(4,5)6/h7-22H,1-6H3/b13-11+,14-12+
InChIKey QILGOFZMOIFYLZ-PHEQNACWSA-N
Mol Weight 458.7 g/mol
Molecular Formula C30H34S2
Exact Mass 458.210193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LK7Vg3spbDx
Name 1,4-bis[(E)-2-(4-Tert-butylsulfanylphenyl)vinyl]benzene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 458.210193443 u
Formula C30H34S2
InChI InChI=1S/C30H34S2/c1-29(2,3)31-27-19-15-25(16-20-27)13-11-23-7-9-24(10-8-23)12-14-26-17-21-28(22-18-26)32-30(4,5)6/h7-22H,1-6H3/b13-11+,14-12+
InChIKey QILGOFZMOIFYLZ-PHEQNACWSA-N
Molecular Weight 458.722 g/mol
SMILES C=1(\C=C\C2=CC=C(\C=C\C=3C=CC(SC(C)(C)C)=CC3)C=C2)C=CC(SC(C)(C)C)=CC1