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4-Bromo-2-[(trifluoromethyl)thio]phenol
SpectraBase Compound ID HdCLSdR6VFn
InChI InChI=1S/C7H4BrF3OS/c8-4-1-2-5(12)6(3-4)13-7(9,10)11/h1-3,12H
InChIKey GIAUIBXDRQFJNV-UHFFFAOYSA-N
Mol Weight 273.07 g/mol
Molecular Formula C7H4BrF3OS
Exact Mass 271.911833 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3DjJpFx7Wi
Name 4-Bromo-2-[(trifluoromethyl)thio]phenol
Appearance Orange liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 271.911833411 u
Formula C7H4BrF3OS
GC Oven Program Oven temp 270oC
InChI InChI=1S/C7H4BrF3OS/c8-4-1-2-5(12)6(3-4)13-7(9,10)11/h1-3,12H
InChIKey GIAUIBXDRQFJNV-UHFFFAOYSA-N
Instrument Name Hewlett Packard 6890
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800551
Molecular Weight 273.067 g/mol
Quality 628
Reported Formula C7H4BrF3OS
SMILES OC1=CC=C(C=C1SC(F)(F)F)Br
SPLASH splash10-0kmj-2290000000-5de0a7277f74d179d343
Source of Spectrum K1-2018-3841-3c (DOI: 10.1002/ejoc.201800551)
Wiley ID 1894151