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1-bromo-2,2-dihydroxy-3,3,3-trifluoropropyl 2-thienyl ketone
SpectraBase Compound ID HfETC4zeU4b
InChI InChI=1S/C8H6BrF3O3S/c9-6(7(14,15)8(10,11)12)5(13)4-2-1-3-16-4/h1-3,6,14-15H
InChIKey ACOPGDFDXPPWFE-UHFFFAOYSA-N
Mol Weight 319.09 g/mol
Molecular Formula C8H6BrF3O3S
Exact Mass 317.917313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qqk2yPe429
Name 2-Bromanyl-4,4,4-tris(fluoranyl)-3,3-bis(oxidanyl)-1-thiophen-2-yl-butan-1-one
Alternate Name(s) 2-Bromo-4,4,4-trifluoro-3,3-dihydroxy-1-(2-thienyl)butan-1-one 2-Bromo-4,4,4-trifluoro-3,3-dihydroxy-1-thiophen-2-yl-1-butanone 2-Bromo-4,4,4-trifluoro-3,3-dihydroxy-1-thiophen-2-ylbutan-1-one
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Formula C8H6BrF3O3S
InChI InChI=1S/C8H6BrF3O3S/c9-6(7(14,15)8(10,11)12)5(13)4-2-1-3-16-4/h1-3,6,14-15H
InChIKey ACOPGDFDXPPWFE-UHFFFAOYSA-N
Molecular Weight 319.092 g/mol
SMILES OC(C(C(c1sccc1)=O)Br)(C(F)(F)F)O
SPLASH splash10-03di-0901000000-1778f37dd019d91dc4b3
Source of Spectrum SK-26-3589-5
Wiley ID 867483