SpectraBase Spectrum ID |
CFBxI7I0B58 |
Name |
2-Phenyl-1-(4-chloro-1-naphthyl)-4-quinolone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
381.092041838 u |
Formula |
C25H16ClNO |
InChI |
InChI=1S/C25H16ClNO/c26-21-14-15-23(19-11-5-4-10-18(19)21)27-22-13-7-6-12-20(22)25(28)16-24(27)17-8-2-1-3-9-17/h1-16H |
InChIKey |
VKPTZXSUZXSNNV-UHFFFAOYSA-N |
Molecular Weight |
381.862 g/mol |
SMILES |
C=1(N(C=2C(C(C1)=O)=CC=CC2)C=1C=2C(C(Cl)=CC1)=CC=CC2)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889229 |