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2-[(4-Benzothiazol-2-ylphenylimino)methyl]-4,6-dichlorophenol
SpectraBase Compound ID GbrogOdyn69
InChI InChI=1S/C20H12Cl2N2OS/c21-14-9-13(19(25)16(22)10-14)11-23-15-7-5-12(6-8-15)20-24-17-3-1-2-4-18(17)26-20/h1-11,25H/b23-11+
InChIKey JRDQYUKDHDFUGR-FOKLQQMPSA-N
Mol Weight 399.3 g/mol
Molecular Formula C20H12Cl2N2OS
Exact Mass 398.00474 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1s0MDMmVvc1
Name 2-[(4-Benzothiazol-2-ylphenylimino)methyl]-4,6-dichlorophenol
Comments Computed using HOSE algorithm
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Exact Mass 398.004739587 u
Formula C20H12Cl2N2OS
InChI InChI=1S/C20H12Cl2N2OS/c21-14-9-13(19(25)16(22)10-14)11-23-15-7-5-12(6-8-15)20-24-17-3-1-2-4-18(17)26-20/h1-11,25H/b23-11+
InChIKey JRDQYUKDHDFUGR-FOKLQQMPSA-N
Molecular Weight 399.295 g/mol
SMILES C1=CC=C2C(=C1)N=C(S2)C1=CC=C(C=C1)\N=C\C1=CC(=CC(=C1O)Cl)Cl