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[5-(tert-Butyl)-2-methylphenyl](trifluoromethyl)sulfane
SpectraBase Compound ID 1LtRXsshAhM
InChI InChI=1S/C12H15F3S/c1-8-5-6-9(11(2,3)4)7-10(8)16-12(13,14)15/h5-7H,1-4H3
InChIKey QDJPNOOGCSNZGR-UHFFFAOYSA-N
Mol Weight 248.31 g/mol
Molecular Formula C12H15F3S
Exact Mass 248.084656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9NZLjP2YY2u
Name [5-(tert-Butyl)-2-methylphenyl](trifluoromethyl)sulfane
Appearance Yellow viscous liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15F3S
GC Oven Program Oven temp 270oC
InChI InChI=1S/C12H15F3S/c1-8-5-6-9(11(2,3)4)7-10(8)16-12(13,14)15/h5-7H,1-4H3
InChIKey QDJPNOOGCSNZGR-UHFFFAOYSA-N
Instrument Name Hewlett Packard 6890
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800551
Molecular Weight 248.307 g/mol
SMILES C1=C(C(=CC(=C1)C(C)(C)C)SC(F)(F)F)C
SPLASH splash10-001i-0090000000-bc05e60612f0823921f3
Source of Spectrum K1-2018-3841-3d (DOI: 10.1002/ejoc.201800551)
Wiley ID 1894153