SpectraBase Spectrum ID |
AU1Qn8nWi5Q |
Name |
Benzamide, N-(1-azabicyclo[2.2.2]oct-3-yl)-3,4,5-trimethoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
320.173607257 u |
Formula |
C17H24N2O4 |
InChI |
InChI=1S/C17H24N2O4/c1-21-14-8-12(9-15(22-2)16(14)23-3)17(20)18-13-10-19-6-4-11(13)5-7-19/h8-9,11,13H,4-7,10H2,1-3H3,(H,18,20) |
InChIKey |
SCUJZAWBOCNXGC-UHFFFAOYSA-N |
Molecular Weight |
320.389 g/mol |
SMILES |
C1C2C(NC(C3=CC(OC)=C(OC)C(OC)=C3)=O)CN(C1)CC2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.821463 |