| SpectraBase Compound ID | 1a7jg5Im5lX |
|---|---|
| InChI | InChI=1S/C2H4ClNO2/c3-1-2-4(5)6/h1-2H2 |
| InChIKey | XMZRJPITAOAPLJ-UHFFFAOYSA-N |
| Mol Weight | 109.51 g/mol |
| Molecular Formula | C2H4ClNO2 |
| Exact Mass | 108.993056 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HWZdBYugyVk |
|---|---|
| Name | Ethane, 1-chloro-2-nitro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 108.993056071 u |
| Formula | C2H4ClNO2 |
| InChI | InChI=1S/C2H4ClNO2/c3-1-2-4(5)6/h1-2H2 |
| InChIKey | XMZRJPITAOAPLJ-UHFFFAOYSA-N |
| SMILES | C(N(=O)=O)CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981509 |