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5-Trifluoromethylsulfin-uracil
SpectraBase Compound ID HcLr9e59ApG
InChI InChI=1S/C5H3F3N2O3S/c6-5(7,8)14(13)2-1-9-4(12)10-3(2)11/h1H,(H2,9,10,11,12)
InChIKey QTISZHJSLSEZAA-UHFFFAOYSA-N
Mol Weight 228.15 g/mol
Molecular Formula C5H3F3N2O3S
Exact Mass 227.981648 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8Y7fDXm8Ns
Name 5-Trifluoromethylsulfin-uracil
Alternate Name(s) 5-((trifluoromethyl)sulfinyl)pyrimidine-2,4(1H,3H)-dione
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Formula C5H3F3N2O3S
InChI InChI=1S/C5H3F3N2O3S/c6-5(7,8)14(13)2-1-9-4(12)10-3(2)11/h1H,(H2,9,10,11,12)
InChIKey QTISZHJSLSEZAA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19721050536
Molecular Weight 228.145 g/mol
SMILES N1C(NC=C(C1=O)S(C(F)(F)F)=O)=O
SPLASH splash10-0aor-1900000000-e51bec9ba3196772727a
Source of Spectrum K-105-1772-3
Wiley ID 1794721