| SpectraBase Spectrum ID |
xE8jAZWu0F |
| Name |
N-(3,4-Dimethoxybenzyl)-3,5-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/c1-28-20-4-3-16(11-21(20)29-2)15-26(6-5-25-7-9-30-10-8-25)22(27)17-12-18(23)14-19(24)13-17/h3-4,11-14H,5-10,15H2,1-2H3 |
| InChIKey |
JJTRYPWMNLFUCS-UHFFFAOYSA-N |
| Molecular Weight |
420.457 g/mol |
| SMILES |
C(C1=CC(=CC(=C1)F)F)(=O)N(CCN1CCOCC1)CC1=CC(=C(C=C1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95536 |
