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

*Links on SpectraBase are not permalinks.
2-Propen-1-one, 2-cyano-3-[4-[[4-(dimethylamino)phenyl]azo]phenyl]-1-(4-phenyl-1-piperazinyl)-
SpectraBase Compound ID XDlhQQC8G6
InChI InChI=1S/C28H28N6O/c1-32(2)26-14-12-25(13-15-26)31-30-24-10-8-22(9-11-24)20-23(21-29)28(35)34-18-16-33(17-19-34)27-6-4-3-5-7-27/h3-15,20H,16-19H2,1-2H3/b23-20+,31-30+
InChIKey WHLLOVKMODEHAH-HMGJSGFFSA-N
Mol Weight 464.57 g/mol
Molecular Formula C28H28N6O
Exact Mass 464.23246 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 8MiBCUDZ21u
Name 2-Propen-1-one, 2-cyano-3-[4-[[4-(dimethylamino)phenyl]azo]phenyl]-1-(4-phenyl-1-piperazinyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 464.232459545 u
Formula C28H28N6O
InChI InChI=1S/C28H28N6O/c1-32(2)26-14-12-25(13-15-26)31-30-24-10-8-22(9-11-24)20-23(21-29)28(35)34-18-16-33(17-19-34)27-6-4-3-5-7-27/h3-15,20H,16-19H2,1-2H3/b23-20+,31-30+
InChIKey WHLLOVKMODEHAH-HMGJSGFFSA-N
Molecular Weight 464.573 g/mol
SMILES C1(\N=N\C2=CC=C(N(C)C)C=C2)=CC=C(\C=C/(C#N)C(=O)N2CCN(CC2)C2=CC=CC=C2)C=C1