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2-[(4-Fluorophenyl)-bis(4-methoxyphenyl)methyl]propanedinitrile
SpectraBase Compound ID GjKn46jHDhG
InChI InChI=1S/C24H19FN2O2/c1-28-22-11-5-18(6-12-22)24(20(15-26)16-27,17-3-9-21(25)10-4-17)19-7-13-23(29-2)14-8-19/h3-14,20H,1-2H3
InChIKey BAYPIDDXICNNGP-UHFFFAOYSA-N
Mol Weight 386.43 g/mol
Molecular Formula C24H19FN2O2
Exact Mass 386.143056 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LMEFDbGIESy
Name 2-[(4-Fluorophenyl)-bis(4-methoxyphenyl)methyl]propanedinitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.143056021 u
Formula C24H19FN2O2
InChI InChI=1S/C24H19FN2O2/c1-28-22-11-5-18(6-12-22)24(20(15-26)16-27,17-3-9-21(25)10-4-17)19-7-13-23(29-2)14-8-19/h3-14,20H,1-2H3
InChIKey BAYPIDDXICNNGP-UHFFFAOYSA-N
Molecular Weight 386.426 g/mol
SMILES C(C(C=1C=CC(=CC1)F)(C=1C=CC(=CC1)OC)C=1C=CC(=CC1)OC)(C#N)C#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934034