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(5Z)-5-{4-[(2,6-dichlorobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
SpectraBase Compound ID 6qmPAiwKpTw
InChI InChI=1S/C17H11Cl2NO2S2/c18-13-2-1-3-14(19)12(13)9-22-11-6-4-10(5-7-11)8-15-16(21)20-17(23)24-15/h1-8H,9H2,(H,20,21,23)/b15-8-
InChIKey YPGDSZLDFDWJHA-NVNXTCNLSA-N
Mol Weight 396.31 g/mol
Molecular Formula C17H11Cl2NO2S2
Exact Mass 394.960826 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1KpUsxbYyvS
Name (5Z)-5-{4-[(2,6-Dichlorobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Comments Computed using HOSE algorithm
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Exact Mass 394.960826344 u
Formula C17H11Cl2NO2S2
InChI InChI=1S/C17H11Cl2NO2S2/c18-13-2-1-3-14(19)12(13)9-22-11-6-4-10(5-7-11)8-15-16(21)20-17(23)24-15/h1-8H,9H2,(H,20,21,23)/b15-8-
InChIKey YPGDSZLDFDWJHA-NVNXTCNLSA-N
Molecular Weight 396.306 g/mol
SMILES N1C(\C(SC1=S)=C\C=1C=CC(OCC2=C(Cl)C=CC=C2Cl)=CC1)=O