| SpectraBase Compound ID | LKAJlBAY4R0 |
|---|---|
| InChI | InChI=1S/C4H10N2O2/c1-2-3-4-5-6(7)8/h5H,2-4H2,1H3 |
| InChIKey | FCLOSAGZCUDMFV-UHFFFAOYSA-N |
| Mol Weight | 118.14 g/mol |
| Molecular Formula | C4H10N2O2 |
| Exact Mass | 118.074228 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7xZk1LALvZC |
|---|---|
| Name | 1-Butanamine, N-nitro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 118.074227568 u |
| Formula | C4H10N2O2 |
| InChI | InChI=1S/C4H10N2O2/c1-2-3-4-5-6(7)8/h5H,2-4H2,1H3 |
| InChIKey | FCLOSAGZCUDMFV-UHFFFAOYSA-N |
| Molecular Weight | 118.136 g/mol |
| SMILES | C(NN(=O)=O)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.89872 |