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4-thiazolidinone, 5-[(2E)-3-(4-bromophenyl)-2-propenylidene]-3-ethyl-2-thioxo-, (5E)-
SpectraBase Compound ID B8b4KjllAUR
InChI InChI=1S/C14H12BrNOS2/c1-2-16-13(17)12(19-14(16)18)5-3-4-10-6-8-11(15)9-7-10/h3-9H,2H2,1H3/b4-3+,12-5+
InChIKey SLPFZUHZKFYKIZ-ZDHPXMGNSA-N
Mol Weight 354.28 g/mol
Molecular Formula C14H12BrNOS2
Exact Mass 352.954369 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5tZ31Cj1qlV
Name 4-Thiazolidinone, 5-[(2E)-3-(4-bromophenyl)-2-propenylidene]-3-ethyl-2-thioxo-, (5E)-
Comments Computed using HOSE algorithm
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Exact Mass 352.954369357 u
Formula C14H12BrNOS2
InChI InChI=1S/C14H12BrNOS2/c1-2-16-13(17)12(19-14(16)18)5-3-4-10-6-8-11(15)9-7-10/h3-9H,2H2,1H3/b4-3+,12-5+
InChIKey SLPFZUHZKFYKIZ-ZDHPXMGNSA-N
Molecular Weight 354.280 g/mol
SMILES CCN1C(S\C(C1=O)=C/C=C/C=1C=CC(=CC1)Br)=S