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(4-(4-Ethylphenyl)-2-methylbut-3-yn-2-yl) (p-tolyl) sulfide
SpectraBase Compound ID EfBveOKsmBq
InChI InChI=1S/C20H22S/c1-5-17-8-10-18(11-9-17)14-15-20(3,4)21-19-12-6-16(2)7-13-19/h6-13H,5H2,1-4H3
InChIKey HOPWEZLLHMHBPD-UHFFFAOYSA-N
Mol Weight 294.46 g/mol
Molecular Formula C20H22S
Exact Mass 294.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4LuVsEUHo1k
Name (4-(4-Ethylphenyl)-2-methylbut-3-yn-2-yl) (p-tolyl) sulfide
Appearance Yellow oil
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Formula C20H22S
InChI InChI=1S/C20H22S/c1-5-17-8-10-18(11-9-17)14-15-20(3,4)21-19-12-6-16(2)7-13-19/h6-13H,5H2,1-4H3
InChIKey HOPWEZLLHMHBPD-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200613
Reported Formula C20H23S
SMILES c1(ccc(cc1)C)SC(C#Cc1ccc(cc1)CC)(C)C
SPLASH splash10-00di-0900000000-4c5c30d05667e2a74440
Source of Spectrum ASC-364-SM9-1u
Thin-Layer Chromatography Rf = 0.38 (Hex/CH2Cl2, 20:1)
Wiley ID 1872934