SpectraBase Spectrum ID |
AvLJW0jhdQg |
Name |
N-(2,3,5-Trimethoxybenzyl)-N-[2-(phenylsulfonyl)ethyl]formamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
393.124608633 u |
Formula |
C19H23NO6S |
InChI |
InChI=1S/C19H23NO6S/c1-24-16-11-15(19(26-3)18(12-16)25-2)13-20(14-21)9-10-27(22,23)17-7-5-4-6-8-17/h4-8,11-12,14H,9-10,13H2,1-3H3 |
InChIKey |
SIIDNFPVRPFIEG-UHFFFAOYSA-N |
Molecular Weight |
393.454 g/mol |
SMILES |
C(S(=O)(=O)C=1C=CC=CC1)CN(CC=1C(=C(OC)C=C(C1)OC)OC)C=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.862932 |