SpectraBase Spectrum ID |
HKV6s2l9UjL |
Name |
N-Benzyl-2-[ 6' (5H)-oxophenanthridin-5'-yl]acetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
342.136827826 u |
Formula |
C22H18N2O2 |
InChI |
InChI=1S/C22H18N2O2/c25-21(23-14-16-8-2-1-3-9-16)15-24-20-13-7-6-11-18(20)17-10-4-5-12-19(17)22(24)26/h1-13H,14-15H2,(H,23,25) |
InChIKey |
NJBFADKGDNQNNP-UHFFFAOYSA-N |
Molecular Weight |
342.398 g/mol |
SMILES |
C1(N(C=2C(C=3C=CC=CC13)=CC=CC2)CC(NCC=1C=CC=CC1)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916254 |