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methyl-3-[(trifluoromethyl)thio]thiophene-2-carboxylate
SpectraBase Compound ID 7l1nUfeXZcU
InChI InChI=1S/C7H5F3O2S2/c1-12-6(11)5-4(2-3-13-5)14-7(8,9)10/h2-3H,1H3
InChIKey FDLXUMRYBNMMJC-UHFFFAOYSA-N
Mol Weight 242.23 g/mol
Molecular Formula C7H5F3O2S2
Exact Mass 241.968306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6m3TPoHWg63
Name methyl-3-[(trifluoromethyl)thio]thiophene-2-carboxylate
Appearance Colorless oil
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Exact Mass 241.968306236 u
Formula C7H5F3O2S2
GC Column HP-5 (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C7H5F3O2S2/c1-12-6(11)5-4(2-3-13-5)14-7(8,9)10/h2-3H,1H3
InChIKey FDLXUMRYBNMMJC-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503915
Molecular Weight 242.230 g/mol
Quality 450
Reported Formula C7H5F3O2S2
SMILES C1(SC(F)(F)F)=C(SC=C1)C(OC)=O
SPLASH splash10-01vo-2490000000-d9b536c196a121a0ebfe
Source of Spectrum QE-21-SM37-2x (DOI: 10.1002/chem.201503915)
Wiley ID 1907376