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1-[5-(4-benzyloxy-benzylidene)-4-oxo-4,5-dihydro-thiazol-2-yl]-piperidine-4-carboxylic acid ethyl ester
SpectraBase Compound ID RZxj9z9dNd
InChI InChI=1S/C25H26N2O4S/c1-2-30-24(29)20-12-14-27(15-13-20)25-26-23(28)22(32-25)16-18-8-10-21(11-9-18)31-17-19-6-4-3-5-7-19/h3-11,16,20H,2,12-15,17H2,1H3/b22-16+
InChIKey SZKDWADIJQMOTQ-CJLVFECKSA-N
Mol Weight 450.55 g/mol
Molecular Formula C25H26N2O4S
Exact Mass 450.161328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ClQmMbeBIZe
Name 1-[5-(4-benzyloxy-benzylidene)-4-oxo-4,5-dihydro-thiazol-2-yl]-piperidine-4-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 1-{(5E)-5-[4-(benzyloxy)benzylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}-4-piperidinecarboxylate Ethyl 1-{5-[4-(benzyloxy)benzylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}-4-piperidinecarboxylate
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Formula C25H26N2O4S
InChI InChI=1S/C25H26N2O4S/c1-2-30-24(29)20-12-14-27(15-13-20)25-26-23(28)22(32-25)16-18-8-10-21(11-9-18)31-17-19-6-4-3-5-7-19/h3-11,16,20H,2,12-15,17H2,1H3/b22-16+
InChIKey SZKDWADIJQMOTQ-CJLVFECKSA-N
Molecular Weight 450.553 g/mol
SMILES c1ccc(COc2ccc(\C=C/3C(N=C(S3)N3CCC(C(=O)OCC)CC3)=O)cc2)cc1
SPLASH splash10-0f6x-9310400000-dee4b01148860bf1d6dc
Wiley ID 1436709