| SpectraBase Compound ID | EliiHaqUKda |
|---|---|
| InChI | InChI=1S/C12H9ClN2O/c13-9-6-11(8-12(7-9)15-16)14-10-4-2-1-3-5-10/h1-8,14H |
| InChIKey | KDARSHUPGTXFMP-UHFFFAOYSA-N |
| Mol Weight | 232.67 g/mol |
| Molecular Formula | C12H9ClN2O |
| Exact Mass | 232.040341 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AsxqPde8p9C |
|---|---|
| Name | Chloro-nitrosodiphenylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.040340617 u |
| Formula | C12H9ClN2O |
| InChI | InChI=1S/C12H9ClN2O/c13-9-6-11(8-12(7-9)15-16)14-10-4-2-1-3-5-10/h1-8,14H |
| InChIKey | KDARSHUPGTXFMP-UHFFFAOYSA-N |
| Molecular Weight | 232.670 g/mol |
| SMILES | C1(NC2=CC=CC=C2)=CC(=CC(=C1)Cl)N=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.845539 |