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3,4-Bis(tert-butylphenylmethyl)-2,5-dimethylthiophene S-monoxide
SpectraBase Compound ID AdUUmFltCDC
InChI InChI=1S/C28H36OS/c1-19-25(17-21-9-13-23(14-10-21)27(3,4)5)26(20(2)30(19)29)18-22-11-15-24(16-12-22)28(6,7)8/h9-16H,17-18H2,1-8H3
InChIKey PASRGTPGAGNJGE-UHFFFAOYSA-N
Mol Weight 420.7 g/mol
Molecular Formula C28H36OS
Exact Mass 420.248687 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lf6dMUHfG6y
Name 3,4-Bis(tert-butylphenylmethyl)-2,5-dimethylthiophene S-monoxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H36OS
InChI InChI=1S/C28H36OS/c1-19-25(17-21-9-13-23(14-10-21)27(3,4)5)26(20(2)30(19)29)18-22-11-15-24(16-12-22)28(6,7)8/h9-16H,17-18H2,1-8H3
InChIKey PASRGTPGAGNJGE-UHFFFAOYSA-N
Molecular Weight 420.655 g/mol
SMILES c1([s](c(c(c1Cc1ccc(C(C)(C)C)cc1)Cc1ccc(C(C)(C)C)cc1)C)=O)C
SPLASH splash10-0002-0903600000-1a651f2fab26b920c646
Source of Spectrum KC-0-2972-4
Synonyms 3,4-bis(2,2-dimethyl-1-phenylpropyl)-2,5-dimethylthiophene 1-oxide 3,4-Bis(4-tert-butylphenylmethyl)-2,5-dimethylthiophene S-monoxide 3,4-bis[(4-tert-butylphenyl)methyl]-2,5-dimethylthiophene 1-oxide 3,4-bis[(4-tert-butylphenyl)methyl]-2,5-dimethyl-thiophene 1-oxide
Wiley ID 831563