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

*Links on SpectraBase are not permalinks.
2-(hexahydro-3-methyl-2-thioxo-1-pyrimidinyl)nicotinonitrile
SpectraBase Compound ID DTate3panyU
InChI InChI=1S/C11H12N4S/c1-14-6-3-7-15(11(14)16)10-9(8-12)4-2-5-13-10/h2,4-5H,3,6-7H2,1H3
InChIKey LQXQYMSREUJLGS-UHFFFAOYSA-N
Mol Weight 232.3 g/mol
Molecular Formula C11H12N4S
Exact Mass 232.078268 g/mol
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample G. M. Coppola, Sandoz, Inc., East Hanover, New Jersey
Technique FILM (CAST FROM CHCl3)
Copyright Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol
Copyright Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
  • 2-(3,4,5,6-TETRAHYDRO-3-METHYL-2-THIOXO-PYRIMIDIN-1(2H)-YL)-NICOTINO-NITRILE
  • NICOTINONITRILE, 2-/HEXAHYDRO- 3-METHYL-2-THIOXO-1-PYRIMIDINYL/-,
Title Journal or Book Year
Novel heterocycles. 7. Reaction of 2-chloronicotinonitrile with thioureas. Synthesis of the pyrido[2,3-d]pyrimido-[2,1-b][1,3]thiazine ring system Journal of Heterocyclic Chemistry 1981

KnowItAll NMR Spectral Library

Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

KnowItAll IR, Raman, and UV-Vis Spectral Libraries

Author: Wiley

The KnowItAll IR, Raman, and UV-Vis spectral libraries offer access to the world's largest collection of IR, Raman, and UV-Vis spectra, including the renowned Sadtler spectra. The libraries include a wide range of compounds from pure organics to industrial compounds. Learn more.

Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.