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Propanedinitrile, 2-(1-methyl-2,6-diphenyl-4(1H)-pyridinylidene)-
SpectraBase Compound ID 7uptm5tXlqJ
InChI InChI=1S/C21H15N3/c1-24-20(16-8-4-2-5-9-16)12-18(19(14-22)15-23)13-21(24)17-10-6-3-7-11-17/h2-13H,1H3
InChIKey JWWKGENTSPIMLK-UHFFFAOYSA-N
Mol Weight 309.37 g/mol
Molecular Formula C21H15N3
Exact Mass 309.126597 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5thNHki2jaa
Name Propanedinitrile, 2-(1-methyl-2,6-diphenyl-4(1H)-pyridinylidene)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.126597495 u
Formula C21H15N3
InChI InChI=1S/C21H15N3/c1-24-20(16-8-4-2-5-9-16)12-18(19(14-22)15-23)13-21(24)17-10-6-3-7-11-17/h2-13H,1H3
InChIKey JWWKGENTSPIMLK-UHFFFAOYSA-N
SMILES CN1C(=CC(C=C1C1=CC=CC=C1)=C(C#N)C#N)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.898555