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trans-3-(METHYLTHIO)-5-[2-(3,4-XYLIDINO)VINYL]-4-ISOTHIAZOLECARBONITRILE

View entire compound with spectra: 1 NMR, and 1 FTIR

trans-3-(METHYLTHIO)-5-[2-(3,4-XYLIDINO)VINYL]-4-ISOTHIAZOLECARBONITRILE
SpectraBase Compound ID 58W6xJcVyL1
InChI InChI=1S/C15H15N3S2/c1-10-4-5-12(8-11(10)2)17-7-6-14-13(9-16)15(19-3)18-20-14/h4-8,17H,1-3H3/b7-6+
InChIKey ZYJPGUPOKHLYKT-VOTSOKGWSA-N
Mol Weight 301.43 g/mol
Molecular Formula C15H15N3S2
Exact Mass 301.07074 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G4pevIr9rJ
Name trans-3-(METHYLTHIO)-5-[2-(3,4-XYLIDINO)VINYL]-4-ISOTHIAZOLECARBONITRILE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15N3S2
InChI InChI=1S/C15H15N3S2/c1-10-4-5-12(8-11(10)2)17-7-6-14-13(9-16)15(19-3)18-20-14/h4-8,17H,1-3H3/b7-6+
InChIKey ZYJPGUPOKHLYKT-VOTSOKGWSA-N
Instrument Name BRUKER AC-300
Melting Point 195-197C
Molecular Weight 301.44
Solvent DMSO-d6; Reference=TMS; Temperature 297K