| SpectraBase Spectrum ID |
63PsGnJNZOw |
| Name |
4,4'-((1E,4Z)-7-phenylhepta-1,4-diene-1,3-diyl)bis(methylbenzene) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.219100902 u |
| Formula |
C27H28 |
| InChI |
InChI=1S/C27H28/c1-22-12-16-25(17-13-22)18-21-26(27-19-14-23(2)15-20-27)11-7-6-10-24-8-4-3-5-9-24/h3-5,7-9,11-21,26H,6,10H2,1-2H3/b11-7-,21-18+ |
| InChIKey |
FWPBNPBHTJBGNU-WHOAZRMJSA-N |
| Molecular Weight |
352.521 g/mol |
| SMILES |
C1=C(C=CC(\C=C\C(\C=C/CCC2=CC=CC=C2)C=2C=CC(=CC2)C)=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933172 |
