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trans-2-(2-aminothiazol-4-yl)-2-pentenoic acid ethyl ester
SpectraBase Compound ID GHOMBkpYxCY
InChI InChI=1S/C10H14N2O2S/c1-3-5-7(9(13)14-4-2)8-6-15-10(11)12-8/h5-6H,3-4H2,1-2H3,(H2,11,12)/b7-5+
InChIKey SJNPHOFSWZNSHH-FNORWQNLSA-N
Mol Weight 226.29 g/mol
Molecular Formula C10H14N2O2S
Exact Mass 226.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhKEkZZNLOl
Name trans-2-(2-aminothiazol-4-yl)-2-pentenoic acid ethyl ester
Appearance Orange oil
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Formula C10H14N2O2S
InChI InChI=1S/C10H14N2O2S/c1-3-5-7(9(13)14-4-2)8-6-15-10(11)12-8/h5-6H,3-4H2,1-2H3,(H2,11,12)/b7-5+
InChIKey SJNPHOFSWZNSHH-FNORWQNLSA-N
Ionization Type EI
Molecular Weight 226.294 g/mol
Reported Formula C10H14N2O2S
SMILES Nc1nc(cs1)\C(C(=O)OCC)=C/CC
SPLASH splash10-0udi-0910000000-469dadb0fc626149c46e
Source of Spectrum CN103193731A
Thin-Layer Chromatography Rf = 0.25 (ethyl acetate/petroleum ether, 1:4)
Wiley ID 1847345