SpectraBase Spectrum ID |
8UNBFSuJCL3 |
Name |
1,5-di-p-Tolyl-1,4-pentadien-3-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
262.135765199 u |
Formula |
C19H18O |
InChI |
InChI=1S/C19H18O/c1-15-3-7-17(8-4-15)11-13-19(20)14-12-18-9-5-16(2)6-10-18/h3-14H,1-2H3 |
InChIKey |
GPAAWNJDOIZWQD-UHFFFAOYSA-N |
Molecular Weight |
262.352 g/mol |
SMILES |
C=1C(=CC=C(C1)C)C=CC(C=CC=1C=CC(=CC1)C)=O |
Spectrum/Structure Validation Score (Raman) |
0.908742 |