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(fluoromethyl)(4-nitrophenyl)sulfane
SpectraBase Compound ID AkcHBIf6R6u
InChI InChI=1S/C7H6FNO2S/c8-5-12-7-3-1-6(2-4-7)9(10)11/h1-4H,5H2
InChIKey BCJMGHHBXDBMER-UHFFFAOYSA-N
Mol Weight 187.19 g/mol
Molecular Formula C7H6FNO2S
Exact Mass 187.010328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FWicPY4Ms1t
Name (fluoromethyl)(4-nitrophenyl)sulfane
Alternate Name(s) 1-(fluoromethylthio)-4-nitrobenzene 1-(fluoromethylsulfanyl)-4-nitrobenzene 1-(fluoromethylsulfanyl)-4-nitro-benzene 1-(fluoranylmethylsulfanyl)-4-nitro-benzene
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Formula C7H6FNO2S
InChI InChI=1S/C7H6FNO2S/c8-5-12-7-3-1-6(2-4-7)9(10)11/h1-4H,5H2
InChIKey BCJMGHHBXDBMER-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c3sc51831k
Molecular Weight 187.188 g/mol
SMILES c1cc(SCF)ccc1[N+](=O)[O-]
SPLASH splash10-052r-2900000000-55b787be960234cdc3ed
Source of Spectrum CSS-5-117/SM6-4l
Wiley ID 1755043