SpectraBase Spectrum ID |
IKcAbv1nIS1 |
Name |
(E)-3-(2-Methylphenyl)-1-phenylpropene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
208.125200515 u |
Formula |
C16H16 |
InChI |
InChI=1S/C16H16/c1-14-8-5-6-12-16(14)13-7-11-15-9-3-2-4-10-15/h2-12H,13H2,1H3/b11-7+ |
InChIKey |
FJDOKAPXPSAEQA-YRNVUSSQSA-N |
Molecular Weight |
208.304 g/mol |
SMILES |
C=1C=C(C=CC1)\C=C\CC1=C(C=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950455 |