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trans-5-[2-(DIMETHYLAMINO)VINYL]-3-{[(2-METHYL-4-THIAZOLYL)METHYL]THIO}-4-ISOTHIAZOLECARBONITRILE
SpectraBase Compound ID 5FDMvSrI6UO
InChI InChI=1S/C13H14N4S3/c1-9-15-10(7-18-9)8-19-13-11(6-14)12(20-16-13)4-5-17(2)3/h4-5,7H,8H2,1-3H3/b5-4+
InChIKey XYBRJWVFFYKABN-SNAWJCMRSA-N
Mol Weight 322.46 g/mol
Molecular Formula C13H14N4S3
Exact Mass 322.03806 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JCqnOyCV4e4
Name trans-5-[2-(DIMETHYLAMINO)VINYL]-3-{[(2-METHYL-4-THIAZOLYL)METHYL]THIO}-4-ISOTHIAZOLECARBONITRILE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N4S3
InChI InChI=1S/C13H14N4S3/c1-9-15-10(7-18-9)8-19-13-11(6-14)12(20-16-13)4-5-17(2)3/h4-5,7H,8H2,1-3H3/b5-4+
InChIKey XYBRJWVFFYKABN-SNAWJCMRSA-N
Instrument Name BRUKER AC-300
Melting Point 128-130C
Molecular Weight 322.48
Solvent CDCl3; Reference=TMS; Temperature 297K