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trans-5-(2-ANILINOVINYL)-3-[(2,6-DICHLOROBENZYL)THIO]-4-ISOTHIAZOLECARBONITRILE
SpectraBase Compound ID 4r37XnihFBy
InChI InChI=1S/C19H13Cl2N3S2/c20-16-7-4-8-17(21)15(16)12-25-19-14(11-22)18(26-24-19)9-10-23-13-5-2-1-3-6-13/h1-10,23H,12H2/b10-9+
InChIKey AJOFUSIQLQUTSU-MDZDMXLPSA-N
Mol Weight 418.36 g/mol
Molecular Formula C19H13Cl2N3S2
Exact Mass 416.992795 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G8ZEw62jJRm
Name trans-5-(2-ANILINOVINYL)-3-[(2,6-DICHLOROBENZYL)THIO]-4-ISOTHIAZOLECARBONITRILE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H13Cl2N3S2
InChI InChI=1S/C19H13Cl2N3S2/c20-16-7-4-8-17(21)15(16)12-25-19-14(11-22)18(26-24-19)9-10-23-13-5-2-1-3-6-13/h1-10,23H,12H2/b10-9+
InChIKey AJOFUSIQLQUTSU-MDZDMXLPSA-N
Instrument Name BRUKER AC-300
Melting Point 192-194C
Molecular Weight 418.37
Solvent DMSO-d6; Reference=TMS; Temperature 297K