| SpectraBase Compound ID | IRArDSTSpK0 |
|---|---|
| InChI | InChI=1S/C4H8ClNO2/c1-8-4(7)3(6)2-5/h3H,2,6H2,1H3 |
| InChIKey | KHUDJGGFFNDILT-UHFFFAOYSA-N |
| Mol Weight | 137.57 g/mol |
| Molecular Formula | C4H8ClNO2 |
| Exact Mass | 137.024356 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LB1Upeg7xWT |
|---|---|
| Name | 2-Amino-3-chloro-propionic acid methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 137.024356200 u |
| Formula | C4H8ClNO2 |
| InChI | InChI=1S/C4H8ClNO2/c1-8-4(7)3(6)2-5/h3H,2,6H2,1H3 |
| InChIKey | KHUDJGGFFNDILT-UHFFFAOYSA-N |
| SMILES | C(C(N)CCl)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.943767 |