| SpectraBase Compound ID | HJ0bvYk1la8 |
|---|---|
| InChI | InChI=1S/C6H6N2O/c7-5-1-3-6(8-9)4-2-5/h1-4H,7H2 |
| InChIKey | SALQMMXSINGXMI-UHFFFAOYSA-N |
| Mol Weight | 122.13 g/mol |
| Molecular Formula | C6H6N2O |
| Exact Mass | 122.048013 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4vCDLgz7tXP |
|---|---|
| Name | para-Nitrosoanilin |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 122.048012820 u |
| Formula | C6H6N2O |
| InChI | InChI=1S/C6H6N2O/c7-5-1-3-6(8-9)4-2-5/h1-4H,7H2 |
| InChIKey | SALQMMXSINGXMI-UHFFFAOYSA-N |
| Molecular Weight | 122.127 g/mol |
| SMILES | C1(N=O)=CC=C(N)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93291 |