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1-Cinnamoyl-2,6-diphenyl-4-oxo-cyclohexane-1,3-dicarbonitrile

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1-Cinnamoyl-2,6-diphenyl-4-oxo-cyclohexane-1,3-dicarbonitrile
SpectraBase Compound ID 7sux2aSBIlO
InChI InChI=1S/C29H22N2O2/c30-19-24-26(32)18-25(22-12-6-2-7-13-22)29(20-31,28(24)23-14-8-3-9-15-23)27(33)17-16-21-10-4-1-5-11-21/h1-17,25,28,32H,18H2/b17-16+
InChIKey IUXAMEIQJUXZPT-WUKNDPDISA-N
Mol Weight 430.51 g/mol
Molecular Formula C29H22N2O2
Exact Mass 430.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LfA7tGQHiH7
Name 1-Cinnamoyl-2,6-diphenyl-4-oxo-cyclohexane-1,3-dicarbonitrile
CAS Registry Number 104919-29-1
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C29H22N2O2
InChI InChI=1S/C29H22N2O2/c30-19-24-26(32)18-25(22-12-6-2-7-13-22)29(20-31,28(24)23-14-8-3-9-15-23)27(33)17-16-21-10-4-1-5-11-21/h1-17,25,28,32H,18H2/b17-16+
InChIKey IUXAMEIQJUXZPT-WUKNDPDISA-N
Instrument Name Bruker WM-250
Literature Reference G. Heinisch, W. Holzer, G.A. Nawwar, Monatsh. Chem. 117, 247 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6