![2-[Acetyl(ethenyl)amino]acetic acid methyl ester](/api/spectrum/31AtCa8r0CK/structure.png?h=300&w=458 "2-[Acetyl(ethenyl)amino]acetic acid methyl ester")
| SpectraBase Compound ID | 1OxqK6rjE4P |
|---|---|
| InChI | InChI=1S/C7H11NO3/c1-4-8(6(2)9)5-7(10)11-3/h4H,1,5H2,2-3H3 |
| InChIKey | JYBYFMUDSQJYMS-UHFFFAOYSA-N |
| Mol Weight | 157.17 g/mol |
| Molecular Formula | C7H11NO3 |
| Exact Mass | 157.073893 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 31AtCa8r0CK |
|---|---|
| Name | 2-[Acetyl(ethenyl)amino]acetic acid methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 157.073893215 u |
| Formula | C7H11NO3 |
| InChI | InChI=1S/C7H11NO3/c1-4-8(6(2)9)5-7(10)11-3/h4H,1,5H2,2-3H3 |
| InChIKey | JYBYFMUDSQJYMS-UHFFFAOYSA-N |
| Molecular Weight | 157.169 g/mol |
| SMILES | C(N(CC(=O)OC)C=C)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955238 |