| SpectraBase Compound ID | H04WYhfD2Be |
|---|---|
| InChI | InChI=1S/C7H11NO5/c1-4-8(11)5(6(9)12-2)7(10)13-3/h4H2,1-3H3 |
| InChIKey | GHIOYBKBDRIQPA-UHFFFAOYSA-N |
| Mol Weight | 189.17 g/mol |
| Molecular Formula | C7H11NO5 |
| Exact Mass | 189.063722 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 75TkpqKxkiZ |
|---|---|
| Name | Ethyl bis(methoxycarbonyl)methylenamine, N-oxide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.063722453 u |
| Formula | C7H11NO5 |
| InChI | InChI=1S/C7H11NO5/c1-4-8(11)5(6(9)12-2)7(10)13-3/h4H2,1-3H3 |
| InChIKey | GHIOYBKBDRIQPA-UHFFFAOYSA-N |
| Molecular Weight | 189.167 g/mol |
| SMILES | C(OC)(C(C(=O)OC)=N(=O)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.972094 |