| SpectraBase Spectrum ID |
38dm2X6fDg9 |
| Name |
1-(4-Methoxybenzyl)-6-nitro-2-p-tolylquinolin-4(1H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
400.142307128 u |
| Formula |
C24H20N2O4 |
| InChI |
InChI=1S/C24H20N2O4/c1-16-3-7-18(8-4-16)23-14-24(27)21-13-19(26(28)29)9-12-22(21)25(23)15-17-5-10-20(30-2)11-6-17/h3-14H,15H2,1-2H3 |
| InChIKey |
UOTBWFQIXDBYAX-UHFFFAOYSA-N |
| Molecular Weight |
400.434 g/mol |
| SMILES |
C=1(N(C=2C=CC(=CC2C(C1)=O)[N+](=O)[O-])CC=1C=CC(=CC1)OC)C=1C=CC(=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899088 |
