SpectraBase Spectrum ID |
8NnHMxzgqar |
Name |
2-(2'-Methoxy-4,4'-dimethyl-[1,1'-biphenyl]-2-yl)pyridine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
289.146664235 u |
Formula |
C20H19NO |
InChI |
InChI=1S/C20H19NO/c1-14-7-9-16(17-10-8-15(2)13-20(17)22-3)18(12-14)19-6-4-5-11-21-19/h4-13H,1-3H3 |
InChIKey |
ZUMUBHCAYQSOTK-UHFFFAOYSA-N |
SMILES |
C=1C(=C(C=2C=CC(C)=CC2OC)C=CC1C)C1=NC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889451 |