| SpectraBase Spectrum ID |
3L3CWdk7ddd |
| Name |
2,6-Diphenyl-1,6-heptadiene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.156500644 u |
| Formula |
C19H20 |
| InChI |
InChI=1S/C19H20/c1-16(18-12-5-3-6-13-18)10-9-11-17(2)19-14-7-4-8-15-19/h3-8,12-15H,1-2,9-11H2 |
| InChIKey |
IADWADXXRTZWQV-UHFFFAOYSA-N |
| Molecular Weight |
248.369 g/mol |
| SMILES |
C1=CC(C(CCCC(C2=CC=CC=C2)=C)=C)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949374 |
