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2-(Ethoxycarbonyl)ethyl hex-3-en-1-yl sulfide
SpectraBase Compound ID 7BCLp1zgt6h
InChI InChI=1S/C11H20O2S/c1-3-5-6-7-9-14-10-8-11(12)13-4-2/h5-6H,3-4,7-10H2,1-2H3/b6-5+
InChIKey NSUXHIBTNLXYTG-AATRIKPKSA-N
Mol Weight 216.34 g/mol
Molecular Formula C11H20O2S
Exact Mass 216.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K35hLu6YdKj
Name 2-(Ethoxycarbonyl)ethyl hex-3-en-1-yl sulfide
Alternate Name(s) ethyl 3-[(3E)-3-hexenylsulfanyl]propanoate
Comments Less than 3 mono-isotopic peaks
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Formula C11H20O2S
InChI InChI=1S/C11H20O2S/c1-3-5-6-7-9-14-10-8-11(12)13-4-2/h5-6H,3-4,7-10H2,1-2H3/b6-5+
InChIKey NSUXHIBTNLXYTG-AATRIKPKSA-N
Molecular Weight 216.339 g/mol
SMILES C(CCSCC\C=C\CC)(=O)OCC
SPLASH splash10-014i-0930000000-200ff45fde97d89075f2
Source of Spectrum J-61-6788-17
Wiley ID 1215299