SpectraBase Spectrum ID |
AiB3GgbBlAe |
Name |
Benzamide, 3,4-dimethoxy-N-benzyl-N-heptyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
369.230393859 u |
Formula |
C23H31NO3 |
InChI |
InChI=1S/C23H31NO3/c1-4-5-6-7-11-16-24(18-19-12-9-8-10-13-19)23(25)20-14-15-21(26-2)22(17-20)27-3/h8-10,12-15,17H,4-7,11,16,18H2,1-3H3 |
InChIKey |
CBKGYRYFMZJRKN-UHFFFAOYSA-N |
Molecular Weight |
369.505 g/mol |
SMILES |
C(N(CCCCCCC)CC1=CC=CC=C1)(=O)C=1C=C(C(=CC1)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944518 |