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tert-Butyl(2-tolylethynyl)sulfane
SpectraBase Compound ID Jf8s5bbkYAE
InChI InChI=1S/C13H16S/c1-11-7-5-6-8-12(11)9-10-14-13(2,3)4/h5-8H,1-4H3
InChIKey ACGKNAKEXUWSCK-UHFFFAOYSA-N
Mol Weight 204.33 g/mol
Molecular Formula C13H16S
Exact Mass 204.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRbgLJ3THKu
Name tert-Butyl(2-tolylethynyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16S
InChI InChI=1S/C13H16S/c1-11-7-5-6-8-12(11)9-10-14-13(2,3)4/h5-8H,1-4H3
InChIKey ACGKNAKEXUWSCK-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5OB00494B
Molecular Weight 204.331 g/mol
SMILES c1cc(c(cc1)C)C#CSC(C)(C)C
SPLASH splash10-0f6t-4950000000-d5f7f7b6f62b39ffee73
Source of Spectrum F5-13-5859/SM10-2i
Synonyms tert-Butyl(o-tolylethynyl)sulfane
Wiley ID 1806887