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(2Z)-2-cyano-N-cyclohexyl-3-[3-methoxy-4-(1-naphthylmethoxy)phenyl]-2-propenamide
SpectraBase Compound ID KIsV7rOrqpl
InChI InChI=1S/C28H28N2O3/c1-32-27-17-20(16-23(18-29)28(31)30-24-11-3-2-4-12-24)14-15-26(27)33-19-22-10-7-9-21-8-5-6-13-25(21)22/h5-10,13-17,24H,2-4,11-12,19H2,1H3,(H,30,31)/b23-16-
InChIKey XMTFWFTXFGTODP-KQWNVCNZSA-N
Mol Weight 440.54 g/mol
Molecular Formula C28H28N2O3
Exact Mass 440.209993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8KaExRP6hXK
Name (2Z)-2-Cyano-N-cyclohexyl-3-[3-methoxy-4-(1-naphthylmethoxy)phenyl]-2-propenamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 440.209992767 u
Formula C28H28N2O3
InChI InChI=1S/C28H28N2O3/c1-32-27-17-20(16-23(18-29)28(31)30-24-11-3-2-4-12-24)14-15-26(27)33-19-22-10-7-9-21-8-5-6-13-25(21)22/h5-10,13-17,24H,2-4,11-12,19H2,1H3,(H,30,31)/b23-16-
InChIKey XMTFWFTXFGTODP-KQWNVCNZSA-N
Molecular Weight 440.543 g/mol
SMILES N(C(\C(=C/C=1C=C(OC)C(=CC1)OCC=1C2=C(C=CC1)C=CC=C2)C#N)=O)C1CCCCC1