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3-Methyl-2-methylthio-1-nitrobut-1-ene
SpectraBase Compound ID EOuAqnMId3E
InChI InChI=1S/C6H11NO2S/c1-5(2)6(10-3)4-7(8)9/h4-5H,1-3H3/b6-4-
InChIKey DNACRSQKHDWAAG-XQRVVYSFSA-N
Mol Weight 161.22 g/mol
Molecular Formula C6H11NO2S
Exact Mass 161.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbzT3W51eYX
Name 3-Methyl-2-methylthio-1-nitrobut-1-ene
Comments Less than 3 mono-isotopic peaks
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Formula C6H11NO2S
InChI InChI=1S/C6H11NO2S/c1-5(2)6(10-3)4-7(8)9/h4-5H,1-3H3/b6-4-
InChIKey DNACRSQKHDWAAG-XQRVVYSFSA-N
Molecular Weight 161.219 g/mol
SMILES CS\C(=C/N(=O)=O)C(C)C
SPLASH splash10-03dj-6900000000-d895b33aa56b9cdf2657
Source of Spectrum F-54-12979-2
Synonyms (1Z)-3-methyl-2-(methylsulfanyl)-1-nitro-1-butene (Z)-1-isopropyl-2-nitroethenyl methyl sulfide
Wiley ID 809496