| SpectraBase Spectrum ID |
LGXH9stEOrR |
| Name |
7-(Diethylamino)-3-(2-ketochromene-3-carbonyl)coumarin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.126322711 u |
| Formula |
C23H19NO5 |
| InChI |
InChI=1S/C23H19NO5/c1-3-24(4-2)16-10-9-15-12-18(23(27)29-20(15)13-16)21(25)17-11-14-7-5-6-8-19(14)28-22(17)26/h5-13H,3-4H2,1-2H3 |
| InChIKey |
JCTAPDOHBVAOHK-UHFFFAOYSA-N |
| Molecular Weight |
389.407 g/mol |
| SMILES |
C=1(C(C=2C(OC=3C(C2)=CC=CC3)=O)=O)C(OC=2C(C1)=CC=C(N(CC)CC)C2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931833 |
