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(5E)-5-[4-(benzyloxy)benzylidene]-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
SpectraBase Compound ID HTJTtRSwik8
InChI InChI=1S/C19H17NO2S2/c1-2-20-18(21)17(24-19(20)23)12-14-8-10-16(11-9-14)22-13-15-6-4-3-5-7-15/h3-12H,2,13H2,1H3/b17-12+
InChIKey SYJWRXVGWSMJGW-SFQUDFHCSA-N
Mol Weight 355.47 g/mol
Molecular Formula C19H17NO2S2
Exact Mass 355.070071 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CiMOSCRLNSz
Name (5E)-5-[4-(Benzyloxy)benzylidene]-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Comments Computed using HOSE algorithm
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Exact Mass 355.070071137 u
Formula C19H17NO2S2
InChI InChI=1S/C19H17NO2S2/c1-2-20-18(21)17(24-19(20)23)12-14-8-10-16(11-9-14)22-13-15-6-4-3-5-7-15/h3-12H,2,13H2,1H3/b17-12+
InChIKey SYJWRXVGWSMJGW-SFQUDFHCSA-N
Molecular Weight 355.470 g/mol
SMILES C1=CC=C(COC2=CC=C(\C=C/3C(N(C(S3)=S)CC)=O)C=C2)C=C1