For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
trans-5-[2-(DIMETHYLAMINO)VINYL]-3-[(p-METHYLBENZYL)THIO]-4-ISOTHIAZOLECARBONITRILE
SpectraBase Compound ID DyH044gmnBq
InChI InChI=1S/C16H17N3S2/c1-12-4-6-13(7-5-12)11-20-16-14(10-17)15(21-18-16)8-9-19(2)3/h4-9H,11H2,1-3H3/b9-8+
InChIKey YQTWLZPVQVBFFK-CMDGGOBGSA-N
Mol Weight 315.45 g/mol
Molecular Formula C16H17N3S2
Exact Mass 315.08639 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7h0YwIc5Dm
Name trans-5-[2-(DIMETHYLAMINO)VINYL]-3-[(p-METHYLBENZYL)THIO]-4-ISOTHIAZOLECARBONITRILE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N3S2
InChI InChI=1S/C16H17N3S2/c1-12-4-6-13(7-5-12)11-20-16-14(10-17)15(21-18-16)8-9-19(2)3/h4-9H,11H2,1-3H3/b9-8+
InChIKey YQTWLZPVQVBFFK-CMDGGOBGSA-N
Instrument Name BRUKER AC-300
Melting Point 124-126C
Molecular Weight 315.46
Solvent CDCl3; Reference=TMS; Temperature 297K