| SpectraBase Spectrum ID |
J7RznYK4BdG |
| Name |
2-Allyl-6-(4-methylphenyl)-4-(2-phenylethyl)pyridazin-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
330.173213335 u |
| Formula |
C22H22N2O |
| InChI |
InChI=1S/C22H22N2O/c1-3-15-24-22(25)20(14-11-18-7-5-4-6-8-18)16-21(23-24)19-12-9-17(2)10-13-19/h3-10,12-13,16H,1,11,14-15H2,2H3 |
| InChIKey |
FFKOYEKEYYXPOA-UHFFFAOYSA-N |
| Molecular Weight |
330.431 g/mol |
| SMILES |
C1(=NN(C(=O)C(CCC=2C=CC=CC2)=C1)CC=C)C1=CC=C(C=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928614 |
