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3-Cyano-4-(furan-2-yl)-6-(naphthalen-1-yl)pyridin-2-yl benzoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-Cyano-4-(furan-2-yl)-6-(naphthalen-1-yl)pyridin-2-yl benzoate
SpectraBase Compound ID HoZY02hFNEf
InChI InChI=1S/C27H16N2O3/c28-17-23-22(25-14-7-15-31-25)16-24(21-13-6-11-18-8-4-5-12-20(18)21)29-26(23)32-27(30)19-9-2-1-3-10-19/h1-16H
InChIKey MFYJTZSMMGSZJK-UHFFFAOYSA-N
Mol Weight 416.44 g/mol
Molecular Formula C27H16N2O3
Exact Mass 416.116092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2T6ojGZCSaP
Name 3-Cyano-4-(furan-2-yl)-6-(naphthalen-1-yl)pyridin-2-ylbenzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.116092380 u
Formula C27H16N2O3
InChI InChI=1S/C27H16N2O3/c28-17-23-22(25-14-7-15-31-25)16-24(21-13-6-11-18-8-4-5-12-20(18)21)29-26(23)32-27(30)19-9-2-1-3-10-19/h1-16H
InChIKey MFYJTZSMMGSZJK-UHFFFAOYSA-N
Molecular Weight 416.436 g/mol
SMILES C=1C=C(C=2C=C(C3=CC=CO3)C(C#N)=C(OC(C3=CC=CC=C3)=O)N2)C2=CC=CC=C2C1