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

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

trans-5-[2-(DIMETHYLAMINO)VINYL]-3-(METHYLTHIO)-4-ISOTHIAZOLECARBONITRILE
SpectraBase Compound ID 9sU2unrVl7L
InChI InChI=1S/C9H11N3S2/c1-12(2)5-4-8-7(6-10)9(13-3)11-14-8/h4-5H,1-3H3/b5-4+
InChIKey VAQNVGNVNAYIBX-SNAWJCMRSA-N
Mol Weight 225.33 g/mol
Molecular Formula C9H11N3S2
Exact Mass 225.03944 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8916mjBG8FF
Name trans-5-[2-(DIMETHYLAMINO)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 C9H11N3S2
InChI InChI=1S/C9H11N3S2/c1-12(2)5-4-8-7(6-10)9(13-3)11-14-8/h4-5H,1-3H3/b5-4+
InChIKey VAQNVGNVNAYIBX-SNAWJCMRSA-N
Instrument Name BRUKER AC-300
Melting Point 144-146C
Molecular Weight 225.34
Solvent CDCl3; Reference=TMS; Temperature 297K