SpectraBase Spectrum ID |
eiAX7L0k99 |
Name |
6-Benzyl-1-phenyl-1,2,3,4,5,6,7,8-octahydro-1,6-naphthridine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
304.193948781 u |
Formula |
C21H24N2 |
InChI |
InChI=1S/C21H24N2/c1-3-8-18(9-4-1)16-22-15-13-21-19(17-22)10-7-14-23(21)20-11-5-2-6-12-20/h1-6,8-9,11-12H,7,10,13-17H2 |
InChIKey |
UNSWGMGHNLFKNW-UHFFFAOYSA-N |
SMILES |
C=12N(C=3C=CC=CC3)CCCC1CN(CC2)CC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834518 |