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Ethyl [(2-Hexanoylthien-3-yl)mercapto]acetate
SpectraBase Compound ID KFTHPFi9Qmy
InChI InChI=1S/C14H20O3S2/c1-3-5-6-7-11(15)14-12(8-9-18-14)19-10-13(16)17-4-2/h8-9H,3-7,10H2,1-2H3
InChIKey GLBKOZOOYBFYNB-UHFFFAOYSA-N
Mol Weight 300.43 g/mol
Molecular Formula C14H20O3S2
Exact Mass 300.085387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PshQy5Qtk
Name Ethyl [(2-Hexanoylthien-3-yl)mercapto]acetate
Alternate Name(s) Ethyl 2-((2-hexanoylthiophen-3-yl)thio)acetate
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Formula C14H20O3S2
InChI InChI=1S/C14H20O3S2/c1-3-5-6-7-11(15)14-12(8-9-18-14)19-10-13(16)17-4-2/h8-9H,3-7,10H2,1-2H3
InChIKey GLBKOZOOYBFYNB-UHFFFAOYSA-N
Molecular Weight 300.431 g/mol
SMILES C(CSc1c(scc1)C(CCCCC)=O)(=O)OCC
SPLASH splash10-05fr-9801000000-06a932756595477b6f26
Source of Spectrum HC-49-234-8
Wiley ID 1733974