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4-(tert-Butyl)-1-methyl-2-[(trifluoromethyl)sulfinyl]benzene
SpectraBase Compound ID 5BIGFgy8ao4
InChI InChI=1S/C12H15F3OS/c1-8-5-6-9(11(2,3)4)7-10(8)17(16)12(13,14)15/h5-7H,1-4H3
InChIKey HYXAOWUQBSGNPS-UHFFFAOYSA-N
Mol Weight 264.31 g/mol
Molecular Formula C12H15F3OS
Exact Mass 264.079571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LRi35QFYAw9
Name 4-(tert-Butyl)-1-methyl-2-[(trifluoromethyl)sulfinyl]benzene
Appearance Colorless liquid
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Exact Mass 264.079570765 u
Formula C12H15F3OS
GC Oven Program Oven temp 270oC
InChI InChI=1S/C12H15F3OS/c1-8-5-6-9(11(2,3)4)7-10(8)17(16)12(13,14)15/h5-7H,1-4H3
InChIKey HYXAOWUQBSGNPS-UHFFFAOYSA-N
Instrument Name Hewlett Packard 6890
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800551
Molecular Weight 264.306 g/mol
Quality 222
Reported Formula C12H15F3OS
SMILES C1=C(C(=CC(=C1)C(C)(C)C)S(C(F)(F)F)=O)C
SPLASH splash10-052b-4900000000-d7ffdcfab50c0058b728
Source of Spectrum K1-2018-3841-3d' (DOI: 10.1002/ejoc.201800551)
Wiley ID 1894152