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sys-1-(4-Cyanophenyl)-2-phenylethene dimer
SpectraBase Compound ID LjAjDVZUuRk
InChI InChI=1S/2C15H11N/c2*16-12-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h2*1-11H/b2*7-6-
InChIKey MCVREBBNHGXLAS-UZICJFINSA-N
Mol Weight 410.52 g/mol
Molecular Formula C30H22N2
Exact Mass 410.178299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BMLkaU75oaz
Name sys-1-(4-Cyanophenyl)-2-phenylethene dimer
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.178298716 u
Formula C30H22N2
InChI InChI=1S/2C15H11N/c2*16-12-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h2*1-11H/b2*7-6-
InChIKey MCVREBBNHGXLAS-UZICJFINSA-N
Molecular Weight 410.520 g/mol
SMILES C(#N)C=1C=CC(\C=C/C2=CC=CC=C2)=CC1.C(#N)C1=CC=C(\C=C/C=2C=CC=CC2)C=C1