| SpectraBase Compound ID | GRUcbv9msye |
|---|---|
| InChI | InChI=1S/C2H4N2O3/c3-2(5)1-4(6)7/h1H2,(H2,3,5) |
| InChIKey | QXDAKFBVTWGQHQ-UHFFFAOYSA-N |
| Mol Weight | 104.06 g/mol |
| Molecular Formula | C2H4N2O3 |
| Exact Mass | 104.022192 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JkQ1Iug4HPQ |
|---|---|
| Name | Nitroacetamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 104.022191994 u |
| Formula | C2H4N2O3 |
| InChI | InChI=1S/C2H4N2O3/c3-2(5)1-4(6)7/h1H2,(H2,3,5) |
| InChIKey | QXDAKFBVTWGQHQ-UHFFFAOYSA-N |
| SMILES | C(CN(=O)=O)(N)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.847321 |