| SpectraBase Spectrum ID |
i4gUxX3In9 |
| Name |
(Z)-3-((2-Hydroxyphenyl)(phenethylimino)methyl)-1-phenethyl-5-(phenethylamino)quinolin-4(1H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
591.288577441 u |
| Formula |
C40H37N3O2 |
| InChI |
InChI=1S/C40H37N3O2/c44-37-22-11-10-19-33(37)39(42-27-24-31-15-6-2-7-16-31)34-29-43(28-25-32-17-8-3-9-18-32)36-21-12-20-35(38(36)40(34)45)41-26-23-30-13-4-1-5-14-30/h1-22,29,41,44H,23-28H2/b42-39- |
| InChIKey |
FRVBENCDQRABKL-RUUVMHMZSA-N |
| Molecular Weight |
591.755 g/mol |
| SMILES |
C1=CC=2N(CCC3=CC=CC=C3)C=C(C(C2C(=C1)NCCC1=CC=CC=C1)=O)\C(C=1C=CC=CC1O)=N/CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942919 |
