SpectraBase Spectrum ID |
KFkSRKMUwdd |
Name |
Benzamide, 3,4,5-trimethoxy-N-propyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
253.131408092 u |
Formula |
C13H19NO4 |
InChI |
InChI=1S/C13H19NO4/c1-5-6-14-13(15)9-7-10(16-2)12(18-4)11(8-9)17-3/h7-8H,5-6H2,1-4H3,(H,14,15) |
InChIKey |
RYJCDOZZSNMNRZ-UHFFFAOYSA-N |
Molecular Weight |
253.298 g/mol |
SMILES |
C(C1=CC(OC)=C(OC)C(=C1)OC)(=O)NCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942183 |