SpectraBase Spectrum ID |
CfSv1izgz4c |
Name |
2,4-Diphenylpentanedinitrile |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
246.115698459 u |
Formula |
C17H14N2 |
InChI |
InChI=1S/C17H14N2/c18-12-16(14-7-3-1-4-8-14)11-17(13-19)15-9-5-2-6-10-15/h1-10,16-17H,11H2 |
InChIKey |
BWTDTZJEXARMAO-UHFFFAOYSA-N |
Molecular Weight |
246.313 g/mol |
SMILES |
C(#N)C(CC(C#N)C1=CC=CC=C1)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970848 |