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(rac)-2-(4-Phenylbutan-2-ylthio)aniline
SpectraBase Compound ID 7RSw4v2VvRT
InChI InChI=1S/C16H19NS/c1-13(11-12-14-7-3-2-4-8-14)18-16-10-6-5-9-15(16)17/h2-10,13H,11-12,17H2,1H3
InChIKey XVYCIKLQKSGRRX-UHFFFAOYSA-N
Mol Weight 257.39 g/mol
Molecular Formula C16H19NS
Exact Mass 257.123821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KjzlFQW4fud
Name (rac)-2-(4-Phenylbutan-2-ylthio)aniline
Alternate Name(s) 2-((4-phenylbutan-2-yl)thio)aniline
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Formula C16H19NS
InChI InChI=1S/C16H19NS/c1-13(11-12-14-7-3-2-4-8-14)18-16-10-6-5-9-15(16)17/h2-10,13H,11-12,17H2,1H3
InChIKey XVYCIKLQKSGRRX-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo402246h
Molecular Weight 257.395 g/mol
SMILES Nc1c(SC(CCc2ccccc2)C)cccc1
SPLASH splash10-0a6u-8790000000-126c85164b910bd15027
Source of Spectrum J-78-12610-50
Wiley ID 1747394