| SpectraBase Compound ID | F9nAt3z2qc7 |
|---|---|
| InChI | InChI=1S/C6H7ClN2/c7-4-1-5(8)3-6(9)2-4/h1-3H,8-9H2 |
| InChIKey | VZNUCJOYPXKLTA-UHFFFAOYSA-N |
| Mol Weight | 142.59 g/mol |
| Molecular Formula | C6H7ClN2 |
| Exact Mass | 142.029776 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DhQlFECSRZa |
|---|---|
| Name | 5-Chloro-1,3-phenylenediamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.029775933 u |
| Formula | C6H7ClN2 |
| InChI | InChI=1S/C6H7ClN2/c7-4-1-5(8)3-6(9)2-4/h1-3H,8-9H2 |
| InChIKey | VZNUCJOYPXKLTA-UHFFFAOYSA-N |
| SMILES | C1=C(C=C(C=C1N)Cl)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.914935 |