| SpectraBase Spectrum ID |
80tmXwiSoIH |
| Name |
2-(3-Acetyl-2-keto-1-phenyl-4-quinolyl)malonic acid diethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
421.152537459 u |
| Formula |
C24H23NO6 |
| InChI |
InChI=1S/C24H23NO6/c1-4-30-23(28)21(24(29)31-5-2)20-17-13-9-10-14-18(17)25(16-11-7-6-8-12-16)22(27)19(20)15(3)26/h6-14,21H,4-5H2,1-3H3 |
| InChIKey |
UCYIMTFBIFTIQJ-UHFFFAOYSA-N |
| Molecular Weight |
421.449 g/mol |
| SMILES |
C=1(C(N(C2=CC=CC=C2)C2=C(C1C(C(=O)OCC)C(=O)OCC)C=CC=C2)=O)C(=O)C |
