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Ethanethioic acid, S-[2-(dodecylamino)-2-oxoethyl] ester
SpectraBase Compound ID HaQ80zWN0GF
InChI InChI=1S/C16H31NO2S/c1-3-4-5-6-7-8-9-10-11-12-13-17-16(19)14-20-15(2)18/h3-14H2,1-2H3,(H,17,19)
InChIKey SGROMZPMUCOBIM-UHFFFAOYSA-N
Mol Weight 301.49 g/mol
Molecular Formula C16H31NO2S
Exact Mass 301.20755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bRXrwmn7bD
Name Ethanethioic acid, S-[2-(dodecylamino)-2-oxoethyl] ester
Alternate Name(s) S-(2-(dodecylamino)-2-oxoethyl) ethanethioate S-[2-(dodecylamino)-2-oxoethyl] ethanethioate Ethanethioic acid S-[2-(dodecylamino)-2-oxoethyl] ester S-[2-(dodecylamino)-2-oxo-ethyl] ethanethioate S-[2-(dodecylamino)-2-oxidanylidene-ethyl] ethanethioate
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Formula C16H31NO2S
InChI InChI=1S/C16H31NO2S/c1-3-4-5-6-7-8-9-10-11-12-13-17-16(19)14-20-15(2)18/h3-14H2,1-2H3,(H,17,19)
InChIKey SGROMZPMUCOBIM-UHFFFAOYSA-N
Molecular Weight 301.489 g/mol
SMILES N(CCCCCCCCCCCC)C(=O)CSC(C)=O
SPLASH splash10-06vl-6390000000-03b818bbdb72cda4ffbb
Source of Spectrum JX-2015-2-1674
Wiley ID 1723303