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N-[(5E)-5-(5-chloro-2-octoxy-benzylidene)-4-keto-2-thiazolin-2-yl]acetamide
SpectraBase Compound ID CALlJNi6y6
InChI InChI=1S/C20H25ClN2O3S/c1-3-4-5-6-7-8-11-26-17-10-9-16(21)12-15(17)13-18-19(25)23-20(27-18)22-14(2)24/h9-10,12-13H,3-8,11H2,1-2H3,(H,22,23,24,25)/b18-13+
InChIKey ADQGQSSIMLYLFZ-QGOAFFKASA-N
Mol Weight 408.94 g/mol
Molecular Formula C20H25ClN2O3S
Exact Mass 408.127442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMwYBfWAH1Q
Name N-[(5E)-5-(5-chloro-2-octoxy-benzylidene)-4-keto-2-thiazolin-2-yl]acetamide
Alternate Name(s) N-[(5E)-5-[(5-chloranyl-2-octoxy-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]ethanamide N-[(5E)-5-[(5-chloro-2-octoxy-phenyl)methylene]-4-oxo-thiazol-2-yl]acetamide N-[(5E)-5-[(5-chloro-2-octoxyphenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]acetamide N-[(5E)-5-[(5-chloro-2-octoxyphenyl)methylidene]-4-oxo-2-thiazolyl]acetamide N-{(2Z,5E)-5-[5-chloro-2-(octyloxy)benzylidene]-4-oxo-1,3-thiazolidin-2-ylidene}acetamide
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Formula C20H25ClN2O3S
InChI InChI=1S/C20H25ClN2O3S/c1-3-4-5-6-7-8-11-26-17-10-9-16(21)12-15(17)13-18-19(25)23-20(27-18)22-14(2)24/h9-10,12-13H,3-8,11H2,1-2H3,(H,22,23,24,25)/b18-13+
InChIKey ADQGQSSIMLYLFZ-QGOAFFKASA-N
Molecular Weight 408.944 g/mol
SMILES N1C(\C(S\C1=N\C(=O)C)=C/c1c(ccc(c1)Cl)OCCCCCCCC)=O
SPLASH splash10-0006-9420000000-c11c7451b1ede7beb7b5
Wiley ID 1447006