| SpectraBase Compound ID | 8G7sHHT90qq |
|---|---|
| InChI | InChI=1S/C5H9NO4/c1-6(2-4(7)8)3-5(9)10/h2-3H2,1H3,(H,7,8)(H,9,10) |
| InChIKey | XWSGEVNYFYKXCP-UHFFFAOYSA-N |
| Mol Weight | 147.13 g/mol |
| Molecular Formula | C5H9NO4 |
| Exact Mass | 147.053158 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KXadFlJP1de |
|---|---|
| Name | (Methylimino)diacetic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 147.053157770 u |
| Formula | C5H9NO4 |
| InChI | InChI=1S/C5H9NO4/c1-6(2-4(7)8)3-5(9)10/h2-3H2,1H3,(H,7,8)(H,9,10) |
| InChIKey | XWSGEVNYFYKXCP-UHFFFAOYSA-N |
| SMILES | OC(CN(CC(O)=O)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.975505 |