| SpectraBase Spectrum ID |
76SvASJU8kD |
| Name |
N-(3,4-Dimethoxybenzyl)-2,5-difluoro-N-(2-morpholinoethyl)benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
420.186063647 u |
| Formula |
C22H26F2N2O4 |
| InChI |
InChI=1S/C22H26F2N2O4/c1-28-20-6-3-16(13-21(20)29-2)15-26(8-7-25-9-11-30-12-10-25)22(27)18-14-17(23)4-5-19(18)24/h3-6,13-14H,7-12,15H2,1-2H3 |
| InChIKey |
VECURYFEZYZHOE-UHFFFAOYSA-N |
| Molecular Weight |
420.457 g/mol |
| SMILES |
C(C1=C(C=CC(=C1)F)F)(=O)N(CCN1CCOCC1)CC1=CC(=C(C=C1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94288 |
