| SpectraBase Spectrum ID |
AKGnDSj3ezn |
| Name |
N,N-Diethyl-2-(4-ketochromen-3-yl)benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
321.136493473 u |
| Formula |
C20H19NO3 |
| InChI |
InChI=1S/C20H19NO3/c1-3-21(4-2)20(23)15-10-6-5-9-14(15)17-13-24-18-12-8-7-11-16(18)19(17)22/h5-13H,3-4H2,1-2H3 |
| InChIKey |
SSEMMBSGSFBRPO-UHFFFAOYSA-N |
| Molecular Weight |
321.376 g/mol |
| SMILES |
C=1(C(C2=CC=CC=C2OC1)=O)C=1C(C(N(CC)CC)=O)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94137 |
