| SpectraBase Compound ID | CFtG5FAiwoS |
|---|---|
| InChI | InChI=1S/C5H11NO2/c1-5(7)8-4-3-6-2/h6H,3-4H2,1-2H3 |
| InChIKey | ZKXGCJWETIMHPS-UHFFFAOYSA-N |
| Mol Weight | 117.15 g/mol |
| Molecular Formula | C5H11NO2 |
| Exact Mass | 117.078979 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6NRE7Ac8otL |
|---|---|
| Name | Acetic acid, 2-(methylaminoethyl) ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 117.078978596 u |
| Formula | C5H11NO2 |
| InChI | InChI=1S/C5H11NO2/c1-5(7)8-4-3-6-2/h6H,3-4H2,1-2H3 |
| InChIKey | ZKXGCJWETIMHPS-UHFFFAOYSA-N |
| Molecular Weight | 117.148 g/mol |
| SMILES | C(COC(C)=O)NC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964186 |