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Rac-Bis(1-phenylethyl)sulfane
SpectraBase Compound ID KEbhMKLtMhC
InChI InChI=1S/C16H18S/c1-13(15-9-5-3-6-10-15)17-14(2)16-11-7-4-8-12-16/h3-14H,1-2H3
InChIKey NTKXWHALINJHQX-UHFFFAOYSA-N
Mol Weight 242.38 g/mol
Molecular Formula C16H18S
Exact Mass 242.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55IzPXYPqEl
Name bis(1-phenylethyl)sulfide
Appearance Colourless oil
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Exact Mass 242.112921754 u
Formula C16H18S
InChI InChI=1S/C16H18S/c1-13(15-9-5-3-6-10-15)17-14(2)16-11-7-4-8-12-16/h3-14H,1-2H3
InChIKey NTKXWHALINJHQX-UHFFFAOYSA-N
Instrument Name JEOL AccuTOF GCx
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/ejoc.202201383
Molecular Weight 242.380 g/mol
Quality 87
SMILES C=1C=C(C=CC1)C(SC(C1=CC=CC=C1)C)C
SPLASH splash10-0a4i-1900000000-86fc6be39b66f5dff2f3
Source of Spectrum K1-26-SM24-2s (DOI: 10.1002/ejoc.202201383)
Thin-Layer Chromatography 0.52 (SiO2, PE/DCM, 10:1)
Wiley ID 1910533