| SpectraBase Compound ID | GGbUFDwF6aV |
|---|---|
| InChI | InChI=1S/C11H11NO7/c1-7(13)17-8(2)18-11(14)19-10-5-3-9(4-6-10)12(15)16/h3-6,8H,1-2H3 |
| InChIKey | LUJRIWGEPQDLNV-UHFFFAOYSA-N |
| Mol Weight | 269.21 g/mol |
| Molecular Formula | C11H11NO7 |
| Exact Mass | 269.053552 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4mpIJFXjNCV |
|---|---|
| Name | 1-Acetoxyethyl 4-nitrophenyl carbonate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.053551691 u |
| Formula | C11H11NO7 |
| InChI | InChI=1S/C11H11NO7/c1-7(13)17-8(2)18-11(14)19-10-5-3-9(4-6-10)12(15)16/h3-6,8H,1-2H3 |
| InChIKey | LUJRIWGEPQDLNV-UHFFFAOYSA-N |
| SMILES | C(OC=1C=CC(=CC1)N(=O)=O)(=O)OC(C)OC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.876258 |