| SpectraBase Compound ID | Be9hNw4NOTz |
|---|---|
| InChI | InChI=1S/C6H11NO2/c1-5(2)6(8)9-4-3-7/h1,3-4,7H2,2H3 |
| InChIKey | QLIBJPGWWSHWBF-UHFFFAOYSA-N |
| Mol Weight | 129.16 g/mol |
| Molecular Formula | C6H11NO2 |
| Exact Mass | 129.078979 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7hbZ1CDmV2t |
|---|---|
| Name | 2-Propenoic acid, 2-methyl-, 2-aminoethyl ester, hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 129.078978596 u |
| Formula | C6H11NO2 |
| InChI | InChI=1S/C6H11NO2/c1-5(2)6(8)9-4-3-7/h1,3-4,7H2,2H3 |
| InChIKey | QLIBJPGWWSHWBF-UHFFFAOYSA-N |
| SMILES | C(N)COC(C(C)=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941734 |