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trans-5-[2-(2,4-DIFLUOROANILINO)VINYL]-3-(METHYLTHIO)-4-ISOTHIAZOLECARBONITRILE
SpectraBase Compound ID BdkmXB1bGsv
InChI InChI=1S/C13H9F2N3S2/c1-19-13-9(7-16)12(20-18-13)4-5-17-11-3-2-8(14)6-10(11)15/h2-6,17H,1H3/b5-4+
InChIKey GGTNFZAMBPSITE-SNAWJCMRSA-N
Mol Weight 309.35 g/mol
Molecular Formula C13H9F2N3S2
Exact Mass 309.020596 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9NABMPBE9sS
Name trans-5-[2-(2,4-DIFLUOROANILINO)VINYL]-3-(METHYLTHIO)-4-ISOTHIAZOLECARBONITRILE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9F2N3S2
InChI InChI=1S/C13H9F2N3S2/c1-19-13-9(7-16)12(20-18-13)4-5-17-11-3-2-8(14)6-10(11)15/h2-6,17H,1H3/b5-4+
InChIKey GGTNFZAMBPSITE-SNAWJCMRSA-N
Instrument Name BRUKER AC-300
Melting Point 192-194C
Molecular Weight 309.36
Solvent DMSO-d6; Reference=TMS; Temperature 297K