| SpectraBase Compound ID | 2SljAdrdXbm |
|---|---|
| InChI | 1S/C4H7NO2/c6-4(7)3-1-5-2-3/h3,5H,1-2H2,(H,6,7) |
| InChIKey | GFZWHAAOIVMHOI-UHFFFAOYSA-N |
| Mol Weight | 101.1 g/mol |
| Molecular Formula | C4H7NO2 |
| Exact Mass | 101.047678 g/mol |
| SpectraBase Spectrum ID | 3FQknalirdX |
|---|---|
| Name | 3-Azetidinecarboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 101.047678467 u |
| Formula | C4H7NO2 |
| InChI | InChI=1S/C4H7NO2/c6-4(7)3-1-5-2-3/h3,5H,1-2H2,(H,6,7) |
| InChIKey | GFZWHAAOIVMHOI-UHFFFAOYSA-N |
| Molecular Weight | 101.105 g/mol |
| SMILES | C(C1CNC1)(=O)O |
| Spectrum/Structure Validation Score (Raman) | 0.991871 |