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(E/Z)-(1,4-Di-p-tolylbut-1-en-3-yn-1-yl)(4-methylbenzyl)sulfane
SpectraBase Compound ID 1Gji8Zpk3dj
InChI InChI=1S/C26H24S/c1-20-7-13-23(14-8-20)5-4-6-26(25-17-11-22(3)12-18-25)27-19-24-15-9-21(2)10-16-24/h6-18H,19H2,1-3H3/b26-6+
InChIKey CRXWTXYWYAGSEF-GOTRBWPWSA-N
Mol Weight 368.54 g/mol
Molecular Formula C26H24S
Exact Mass 368.159872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FJSf4MlFr9
Name (E/Z)-(1,4-Di-p-tolylbut-1-en-3-yn-1-yl)(4-methylbenzyl)sulfane
Alternate Name(s) (E)-(1,4-di-p-tolylbut-1-en-3-yn-1-yl)(4-methylbenzyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24S
InChI InChI=1S/C26H24S/c1-20-7-13-23(14-8-20)5-4-6-26(25-17-11-22(3)12-18-25)27-19-24-15-9-21(2)10-16-24/h6-18H,19H2,1-3H3/b26-6+
InChIKey CRXWTXYWYAGSEF-GOTRBWPWSA-N
Molecular Weight 368.538 g/mol
SMILES C(#Cc1ccc(cc1)C)\C=C/(SCc1ccc(cc1)C)c1ccc(cc1)C
SPLASH splash10-066r-0769000000-0e05f3d0a6607a7f06de
Source of Spectrum F4-46-3421-5
Wiley ID 1742312