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4-[(N-Cyclohexylthiocarbamoyl)thio]butyric acid
SpectraBase Compound ID JSnrOFDzPcp
InChI InChI=1S/C11H19NO2S2/c13-10(14)7-4-8-16-11(15)12-9-5-2-1-3-6-9/h9H,1-8H2,(H,12,15)(H,13,14)
InChIKey WNOHBDZXWQIVCK-UHFFFAOYSA-N
Mol Weight 261.4 g/mol
Molecular Formula C11H19NO2S2
Exact Mass 261.085721 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fK8UpkjHwL
Name 4-[(N-Cyclohexylthiocarbamoyl)thio]butyric acid
Alternate Name(s) 4-{[(cyclohexylamino)carbothioyl]sulfanyl}butanoic acid 4-[[(cyclohexylamino)-sulfanylidenemethyl]thio]butanoic acid 4-(cyclohexylcarbamothioylsulfanyl)butanoic acid
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Formula C11H19NO2S2
InChI InChI=1S/C11H19NO2S2/c13-10(14)7-4-8-16-11(15)12-9-5-2-1-3-6-9/h9H,1-8H2,(H,12,15)(H,13,14)
InChIKey WNOHBDZXWQIVCK-UHFFFAOYSA-N
Molecular Weight 261.398 g/mol
SMILES OC(CCCSC(NC1CCCCC1)=S)=O
SPLASH splash10-000x-3900000000-fbd4cf5a9644e4ea310f
Source of Spectrum Y-36-1170-3
Wiley ID 762459