| SpectraBase Spectrum ID |
BJQqw13asAd |
| Name |
1-Benzoyl-2-(4-chlorobenzoyl)-3-(4-chlorophenyl)-cyclopropane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.052735153 u |
| Formula |
C23H16Cl2O2 |
| InChI |
InChI=1S/C23H16Cl2O2/c24-17-10-6-14(7-11-17)19-20(22(26)15-4-2-1-3-5-15)21(19)23(27)16-8-12-18(25)13-9-16/h1-13,19-21H |
| InChIKey |
CGLJSLYQSFFPIG-UHFFFAOYSA-N |
| Molecular Weight |
395.285 g/mol |
| SMILES |
C1(C(=O)C2=CC=C(C=C2)Cl)C(C(=O)C2=CC=CC=C2)C1C1=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.881693 |
