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QSBPESLWDKAWRZ-QPJJXVBHSA-N
SpectraBase Compound ID B8O2K3bSNRb
InChI InChI=1S/C8H16N2OS/c1-12-7-4-8(11)10-6-3-2-5-9/h4,7H,2-3,5-6,9H2,1H3,(H,10,11)/b7-4+
InChIKey QSBPESLWDKAWRZ-QPJJXVBHSA-N
Mol Weight 188.29 g/mol
Molecular Formula C8H16N2OS
Exact Mass 188.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kuHaVHbi19
Name (E)-N-(4-aminobutyl)-3-(methylthio)-2-propenamide
Alternate Name(s) (E)-N-(4-aminobutyl)-3-(methylthio)acrylamide (E)-N-(4-aminobutyl)-3-methylsulfanyl-prop-2-enamide (E)-N-(4-azanylbutyl)-3-methylsulfanyl-prop-2-enamide
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Formula C8H16N2OS
InChI InChI=1S/C8H16N2OS/c1-12-7-4-8(11)10-6-3-2-5-9/h4,7H,2-3,5-6,9H2,1H3,(H,10,11)/b7-4+
InChIKey QSBPESLWDKAWRZ-QPJJXVBHSA-N
Molecular Weight 188.289 g/mol
SMILES N(C(\C=C\SC)=O)CCCCN
SPLASH splash10-00di-4900000000-2519af491c05ef57afca
Source of Spectrum G4-63-619-2
Wiley ID 1608393