| SpectraBase Spectrum ID |
HAww0OvyJGa |
| Name |
(E,Z)-1-(1,1'-Biphenyl-2-yl)-1-(4-chlorophenyl)-1,3-butadiene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.101878247 u |
| Formula |
C22H17Cl |
| InChI |
InChI=1S/C22H17Cl/c1-2-6-22(20-13-15-21(23)16-14-20)19-11-9-18(10-12-19)17-7-4-3-5-8-17/h2-16H,1H2/b22-6+ |
| InChIKey |
WHYDKZBIOHWKTQ-GEVRCRHISA-N |
| Molecular Weight |
316.831 g/mol |
| SMILES |
C1(\C(C2=CC=C(C3=CC=CC=C3)C=C2)=C\C=C)=CC=C(Cl)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.832457 |
