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((4-Bromophenyl)ethynyl)(tert-butyl)sulfane

View entire compound with spectra: 2 MS (GC)

((4-Bromophenyl)ethynyl)(tert-butyl)sulfane
SpectraBase Compound ID 6aRUyBpupx9
InChI InChI=1S/C12H13BrS/c1-12(2,3)14-9-8-10-4-6-11(13)7-5-10/h4-7H,1-3H3
InChIKey WHWHVLUZGXPROO-UHFFFAOYSA-N
Mol Weight 269.2 g/mol
Molecular Formula C12H13BrS
Exact Mass 267.992135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3r5JunDOWSg
Name ((4-bromophenyl)ethynyl)(tert-butyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13BrS
InChI InChI=1S/C12H13BrS/c1-12(2,3)14-9-8-10-4-6-11(13)7-5-10/h4-7H,1-3H3
InChIKey WHWHVLUZGXPROO-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5OB00494B
Molecular Weight 269.200 g/mol
SMILES c1cc(ccc1Br)C#CSC(C)(C)C
SPLASH splash10-01qi-9040000000-ea44c0e5cc0ba91685d1
Source of Spectrum F5-13-5859/SM9-2e
Wiley ID 1806884