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trans-3-[(p-CHLOROBENZYL)THIO]-5-[2-(DIMETHYLAMINO)VINYL]-4-ISOTHIAZOLECARBONITRILE
SpectraBase Compound ID 59Eus1IsjYD
InChI InChI=1S/C15H14ClN3S2/c1-19(2)8-7-14-13(9-17)15(18-21-14)20-10-11-3-5-12(16)6-4-11/h3-8H,10H2,1-2H3/b8-7+
InChIKey UJGLTOFNMKWOCK-BQYQJAHWSA-N
Mol Weight 335.87 g/mol
Molecular Formula C15H14ClN3S2
Exact Mass 335.031768 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FgjXvP0HYY6
Name trans-3-[(p-CHLOROBENZYL)THIO]-5-[2-(DIMETHYLAMINO)VINYL]-4-ISOTHIAZOLECARBONITRILE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14ClN3S2
InChI InChI=1S/C15H14ClN3S2/c1-19(2)8-7-14-13(9-17)15(18-21-14)20-10-11-3-5-12(16)6-4-11/h3-8H,10H2,1-2H3/b8-7+
InChIKey UJGLTOFNMKWOCK-BQYQJAHWSA-N
Instrument Name BRUKER AC-300
Melting Point 114-116C
Molecular Weight 335.88
Solvent CDCl3; Reference=TMS; Temperature 297K