| SpectraBase Compound ID | 3OPAVXEJ1bo |
|---|---|
| InChI | InChI=1S/C12H9ClN2O/c13-9-5-7-10(8-6-9)14-11-3-1-2-4-12(11)15-16/h1-8,14H |
| InChIKey | IKAJSAKHALPPNO-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 | 9YwxNd5yPEs |
|---|---|
| Name | N-(4-Chlorophenyl)-2-nitrosoaniline |
| 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/c13-9-5-7-10(8-6-9)14-11-3-1-2-4-12(11)15-16/h1-8,14H |
| InChIKey | IKAJSAKHALPPNO-UHFFFAOYSA-N |
| Molecular Weight | 232.670 g/mol |
| SMILES | C=1(NC2=CC=C(C=C2)Cl)C(N=O)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962407 |