SpectraBase Spectrum ID |
JPGafQ5ZWi5 |
Name |
5-Chloro-3-(4-chlorophenyl)-2-hydroxy-2,3-dihydro-1H-inden-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
292.005784960 u |
Formula |
C15H10Cl2O2 |
InChI |
InChI=1S/C15H10Cl2O2/c16-9-3-1-8(2-4-9)13-12-7-10(17)5-6-11(12)14(18)15(13)19/h1-7,13,15,19H |
InChIKey |
GGTVBUHQGLTQMP-UHFFFAOYSA-N |
Molecular Weight |
293.149 g/mol |
SMILES |
C12=C(C(=O)C(C2C=2C=CC(=CC2)Cl)O)C=CC(=C1)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879612 |