For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2,5-Dimethyl-3,4-bis(p-tert-butylphenyl)thiophene

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

2,5-Dimethyl-3,4-bis(p-tert-butylphenyl)thiophene
SpectraBase Compound ID 97oWPT3smyV
InChI InChI=1S/C28H36S/c1-19-25(17-21-9-13-23(14-10-21)27(3,4)5)26(20(2)29-19)18-22-11-15-24(16-12-22)28(6,7)8/h9-16H,17-18H2,1-8H3
InChIKey NEKLKNLLMVGISV-UHFFFAOYSA-N
Mol Weight 404.7 g/mol
Molecular Formula C28H36S
Exact Mass 404.253772 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IiPYPP77qfD
Name 2,5-Dimethyl-3,4-bis(p-tert-butylphenyl)thiophene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.253772333 u
Formula C28H36S
InChI InChI=1S/C28H36S/c1-19-25(17-21-9-13-23(14-10-21)27(3,4)5)26(20(2)29-19)18-22-11-15-24(16-12-22)28(6,7)8/h9-16H,17-18H2,1-8H3
InChIKey NEKLKNLLMVGISV-UHFFFAOYSA-N
Molecular Weight 404.656 g/mol
SMILES C=1(C(=C(C)SC1C)CC1=CC=C(C(C)(C)C)C=C1)CC1=CC=C(C(C)(C)C)C=C1