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

*Links on SpectraBase are not permalinks.
6-AMINO-4-BENZYL-5-CYANO-1-(2,3-DIHYDROBENZO-[B]-[1,4]-DIOXIN-6-YL)-2(1H)-PYRIMIDINONE
SpectraBase Compound ID HpdmEU7K5AI
InChI InChI=1S/C20H16N4O3/c21-12-15-16(10-13-4-2-1-3-5-13)23-20(25)24(19(15)22)14-6-7-17-18(11-14)27-9-8-26-17/h1-7,11H,8-10,22H2
InChIKey IBVGFWXTVWXWDD-UHFFFAOYSA-N
Mol Weight 360.37 g/mol
Molecular Formula C20H16N4O3
Exact Mass 360.12224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID L6BKoEdFXu8
Name 6-AMINO-4-BENZYL-5-CYANO-1-(2,3-DIHYDROBENZO-[B]-[1,4]-DIOXIN-6-YL)-2(1H)-PYRIMIDINONE
Compound Number 3P
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16N4O3
InChI InChI=1S/C20H16N4O3/c21-12-15-16(10-13-4-2-1-3-5-13)23-20(25)24(19(15)22)14-6-7-17-18(11-14)27-9-8-26-17/h1-7,11H,8-10,22H2
InChIKey IBVGFWXTVWXWDD-UHFFFAOYSA-N
Literature Reference Author E.NAJAHI,J.SUDOR,F.CHABCHOUB,F.NEPVEU,F.ZRIBI,R.DUVAL
Literature Reference Citation MOLECULES,15,8841(2010)
Literature Reference DOI 10.3390/molecules1512884
Molecular Weight 360.372 g/mol
Sample ID 72735
Solvent DMSO-D6