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1-[(5E)-5-(4-chlorobenzylidene)-4-keto-2-thiazolin-2-yl]nipecotic acid ethyl ester
SpectraBase Compound ID DqBbNzvDqkg
InChI InChI=1S/C18H19ClN2O3S/c1-2-24-17(23)13-4-3-9-21(11-13)18-20-16(22)15(25-18)10-12-5-7-14(19)8-6-12/h5-8,10,13H,2-4,9,11H2,1H3/b15-10+
InChIKey LLFQUIJEQNOOTM-XNTDXEJSSA-N
Mol Weight 378.87 g/mol
Molecular Formula C18H19ClN2O3S
Exact Mass 378.080491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JMv1fs6uXHI
Name 1-[(5E)-5-(4-chlorobenzylidene)-4-keto-2-thiazolin-2-yl]nipecotic acid ethyl ester
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Formula C18H19ClN2O3S
InChI InChI=1S/C18H19ClN2O3S/c1-2-24-17(23)13-4-3-9-21(11-13)18-20-16(22)15(25-18)10-12-5-7-14(19)8-6-12/h5-8,10,13H,2-4,9,11H2,1H3/b15-10+
InChIKey LLFQUIJEQNOOTM-XNTDXEJSSA-N
Molecular Weight 378.874 g/mol
SMILES CCOC(C1CN(C2=NC(\C(=C/c3ccc(cc3)Cl)S2)=O)CCC1)=O
SPLASH splash10-014i-1902000000-7634a05bb81a514fb87b
Synonyms 1-[(5E)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-thiazolyl]-3-piperidinecarboxylic acid ethyl ester Ethyl 1-[(5E)-5-[(4-chlorophenyl)methylene]-4-oxo-thiazol-2-yl]piperidine-3-carboxylate Ethyl 1-[(5E)-5-[(4-chlorophenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]piperidine-3-carboxylate Ethyl 1-[(5E)-5-[(4-chlorophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]piperidine-3-carboxylate Piperidine-3-carboxylic acid, 1-[5-(4-chlorobenzylidene)-4-oxo-4,5-dihydrothiazol-2-yl]-, ethyl ester
Wiley ID 1441774