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2-(4-bromophenyl)-5-ethoxy-4-methyl-3-(trifluoromethylthio)furan
SpectraBase Compound ID 28tCTeJ3Uj0
InChI InChI=1S/C14H12BrF3O2S/c1-3-19-13-8(2)12(21-14(16,17)18)11(20-13)9-4-6-10(15)7-5-9/h4-7H,3H2,1-2H3
InChIKey VFCIBVKSURFWHB-UHFFFAOYSA-N
Mol Weight 381.21 g/mol
Molecular Formula C14H12BrF3O2S
Exact Mass 379.969348 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7RF8F0iEKj7
Name 2-(4-bromophenyl)-5-ethoxy-4-methyl-3-(trifluoromethylthio)furan
Appearance Yellow oil
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Formula C14H12BrF3O2S
InChI InChI=1S/C14H12BrF3O2S/c1-3-19-13-8(2)12(21-14(16,17)18)11(20-13)9-4-6-10(15)7-5-9/h4-7H,3H2,1-2H3
InChIKey VFCIBVKSURFWHB-UHFFFAOYSA-N
Instrument Name IonSpec FT-ICR
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000304
Molecular Weight 381.207 g/mol
Reported Formula C14H12BrF3O2S
SMILES c1(oc(c(c1SC(F)(F)F)C)OCC)-c1ccc(cc1)Br
SPLASH splash10-0ue9-0309000000-63aa16bd53be85c3df0c
Source of Spectrum ASC-362-SM12-3h
Wiley ID 1839336