| SpectraBase Spectrum ID |
IB3IXdr5YvH |
| Name |
(4-Chlorophenyl)(2-(4-chlorophenyl)cyclopropyl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.026520405 u |
| Formula |
C16H12Cl2O |
| InChI |
InChI=1S/C16H12Cl2O/c17-12-5-1-10(2-6-12)14-9-15(14)16(19)11-3-7-13(18)8-4-11/h1-8,14-15H,9H2 |
| InChIKey |
JWYMMGBQRDOKQQ-UHFFFAOYSA-N |
| SMILES |
C1(C(C(=O)C=2C=CC(=CC2)Cl)C1)C1=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911599 |