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tert-Butyl((3-methoxyphenyl)ethynyl)sulfane

View entire compound with spectra: 1 MS (GC)

tert-Butyl((3-methoxyphenyl)ethynyl)sulfane
SpectraBase Compound ID K705xuFcbIh
InChI InChI=1S/C13H16OS/c1-13(2,3)15-9-8-11-6-5-7-12(10-11)14-4/h5-7,10H,1-4H3
InChIKey OTDUAOKDXIGMMV-UHFFFAOYSA-N
Mol Weight 220.33 g/mol
Molecular Formula C13H16OS
Exact Mass 220.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVHu42CXlAe
Name tert-Butyl((3-methoxyphenyl)ethynyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16OS
InChI InChI=1S/C13H16OS/c1-13(2,3)15-9-8-11-6-5-7-12(10-11)14-4/h5-7,10H,1-4H3
InChIKey OTDUAOKDXIGMMV-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5OB00494B
Molecular Weight 220.330 g/mol
SMILES c1(cc(ccc1)C#CSC(C)(C)C)OC
SPLASH splash10-03di-0900000000-8fea361f9cf6ea08b88b
Source of Spectrum F5-13-5859/SM9-2d
Wiley ID 1806883