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Bis(3-trifluoromethylbenzyl)sulfide
SpectraBase Compound ID JM0pX07cWgd
InChI InChI=1S/C16H12F6S/c17-15(18,19)13-5-1-3-11(7-13)9-23-10-12-4-2-6-14(8-12)16(20,21)22/h1-8H,9-10H2
InChIKey QJSRLRHNNJRPJE-UHFFFAOYSA-N
Mol Weight 350.32 g/mol
Molecular Formula C16H12F6S
Exact Mass 350.056391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRbIAX5YOI8
Name bis(3-trifluoromethylbenzyl)sulfide
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.056390538 u
Formula C16H12F6S
InChI InChI=1S/C16H12F6S/c17-15(18,19)13-5-1-3-11(7-13)9-23-10-12-4-2-6-14(8-12)16(20,21)22/h1-8H,9-10H2
InChIKey QJSRLRHNNJRPJE-UHFFFAOYSA-N
Instrument Name JEOL AccuTOF GCx
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/ejoc.202201383
Molecular Weight 350.322 g/mol
Quality 80
SMILES C(C1=CC=CC(=C1)CSCC1=CC=CC(=C1)C(F)(F)F)(F)(F)F
SPLASH splash10-0a4i-0901000000-773fbf8b6f72f8de6513
Source of Spectrum K1-26-SM20-2l (DOI: 10.1002/ejoc.202201383)
Thin-Layer Chromatography 0.50 (SiO2, PE/EE, 20:1)
Wiley ID 1910528