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1-(3-methylbut-2-enyl)-2-(2-phenylsulfanylethynyl)benzene
SpectraBase Compound ID 7o09ic6TMeR
InChI InChI=1S/C19H18S/c1-16(2)12-13-17-8-6-7-9-18(17)14-15-20-19-10-4-3-5-11-19/h3-12H,13H2,1-2H3
InChIKey LPEUZIUBUYAQKQ-UHFFFAOYSA-N
Mol Weight 278.41 g/mol
Molecular Formula C19H18S
Exact Mass 278.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjpksgOvulH
Name 1-(3-methylbut-2-enyl)-2-(2-phenylsulfanylethynyl)benzene
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18S
InChI InChI=1S/C19H18S/c1-16(2)12-13-17-8-6-7-9-18(17)14-15-20-19-10-4-3-5-11-19/h3-12H,13H2,1-2H3
InChIKey LPEUZIUBUYAQKQ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.9.263
Molecular Weight 278.413 g/mol
SMILES C(#CSc1ccccc1)c1c(cccc1)CC=C(C)C
SPLASH splash10-004i-0790000000-e214bcb284bdb1be8ca6
Source of Spectrum BJO-9-SM10-1k
Thin-Layer Chromatography Rf = 0.31 (hexane)
Wiley ID 1853758