| SpectraBase Spectrum ID |
BVUdTwFJo5p |
| Name |
2-(bis(4-Chlorophenyl)methylene)-4-chloro-1-phenylbutan-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.034498266 u |
| Formula |
C23H17Cl3O |
| InChI |
InChI=1S/C23H17Cl3O/c24-15-14-21(23(27)18-4-2-1-3-5-18)22(16-6-10-19(25)11-7-16)17-8-12-20(26)13-9-17/h1-13H,14-15H2 |
| InChIKey |
BZFYWNMORZOJPF-UHFFFAOYSA-N |
| Molecular Weight |
415.747 g/mol |
| SMILES |
C(CCCl)(C(C1=CC=CC=C1)=O)=C(C=1C=CC(Cl)=CC1)C=1C=CC(=CC1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897608 |
