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4-(Methylsulphonyl)butanenitrile
SpectraBase Compound ID 3EUvIJjkMRH
InChI InChI=1S/C5H9NO2S/c1-9(7,8)5-3-2-4-6/h2-3,5H2,1H3
InChIKey GFRFYHPRAPQIIX-UHFFFAOYSA-N
Mol Weight 147.19 g/mol
Molecular Formula C5H9NO2S
Exact Mass 147.0354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ll0Iat7UYuF
Name 4-(Methylsulphonyl)butanenitrile
Alternate Name(s) 4-(Methylsulfonyl)butanenitrile 4-Methylsulfonylbutanenitrile
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Formula C5H9NO2S
InChI InChI=1S/C5H9NO2S/c1-9(7,8)5-3-2-4-6/h2-3,5H2,1H3
InChIKey GFRFYHPRAPQIIX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ffj.1163
Molecular Weight 147.192 g/mol
SMILES C(#N)CCCS(=O)(=O)C
SPLASH splash10-0a4i-9000000000-7ae2259e3b5a67d44f26
Source of Spectrum FF-18-150-150_9
Wiley ID 1775335