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

*Links on SpectraBase are not permalinks.
{[(Z)-(1-(4-methylphenyl)-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}acetonitrile
SpectraBase Compound ID 5MY6wuJrICT
InChI InChI=1S/C14H12N4O2S/c1-9-2-4-10(5-3-9)18-13(20)11(8-16-7-6-15)12(19)17-14(18)21/h2-5,8,16H,7H2,1H3,(H,17,19,21)/b11-8-
InChIKey OLLQDVBVSONUEZ-FLIBITNWSA-N
Mol Weight 300.34 g/mol
Molecular Formula C14H12N4O2S
Exact Mass 300.068097 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 HkZsjfQ8vxB
Name {[(Z)-(1-(4-methylphenyl)-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}acetonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C14H12N4O2S/c1-9-2-4-10(5-3-9)18-13(20)11(8-16-7-6-15)12(19)17-14(18)21/h2-5,8,16H,7H2,1H3,(H,17,19,21)/b11-8-
InChIKey OLLQDVBVSONUEZ-FLIBITNWSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3753
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D93796; Labnumber: KV-2570; SBI_ID: SBI-003755
Synonyms {[(1-(4-methylphenyl)-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}acetonitrile
Temperature 315 °C