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4-[(Trifluoromethyl)thio]benzene-1,2-diol
SpectraBase Compound ID EEcPPZjzwcu
InChI InChI=1S/C7H5F3O2S/c8-7(9,10)13-4-1-2-5(11)6(12)3-4/h1-3,11-12H
InChIKey RETIIEYJOYWWQL-UHFFFAOYSA-N
Mol Weight 210.17 g/mol
Molecular Formula C7H5F3O2S
Exact Mass 209.996235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9qrgCSBb9a
Name 4-[(Trifluoromethyl)thio]benzene-1,2-diol
Appearance Brown viscous liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 209.996235062 u
Formula C7H5F3O2S
GC Oven Program Oven temp 270oC
InChI InChI=1S/C7H5F3O2S/c8-7(9,10)13-4-1-2-5(11)6(12)3-4/h1-3,11-12H
InChIKey RETIIEYJOYWWQL-UHFFFAOYSA-N
Instrument Name Hewlett Packard 6890
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800551
Molecular Weight 210.170 g/mol
Quality 290
Reported Formula C7H5F3O2S
SMILES OC=1C=CC(=CC1O)SC(F)(F)F
SPLASH splash10-01ox-3980000000-2088b75652e206b8c801
Source of Spectrum K1-2018-3842-3f (DOI: 10.1002/ejoc.201800551)
Wiley ID 1894154