SpectraBase Spectrum ID |
Gf8WHMNnO3K |
Name |
Benzamide, 2-methoxy-N-benzyl-N-hexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
325.204179111 u |
Formula |
C21H27NO2 |
InChI |
InChI=1S/C21H27NO2/c1-3-4-5-11-16-22(17-18-12-7-6-8-13-18)21(23)19-14-9-10-15-20(19)24-2/h6-10,12-15H,3-5,11,16-17H2,1-2H3 |
InChIKey |
XRWXFULXVZQEKH-UHFFFAOYSA-N |
Molecular Weight |
325.452 g/mol |
SMILES |
C(N(CCCCCC)CC1=CC=CC=C1)(=O)C=1C(OC)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927085 |