| SpectraBase Compound ID | E8W3aWdJOi3 |
|---|---|
| InChI | InChI=1S/C4H7NO2/c5-4(1-2-4)3(6)7/h1-2,5H2,(H,6,7) |
| InChIKey | PAJPWUMXBYXFCZ-UHFFFAOYSA-N |
| Mol Weight | 101.1 g/mol |
| Molecular Formula | C4H7NO2 |
| Exact Mass | 101.047678 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | BIYlRUhmgnI |
|---|---|
| Name | 1-Aminocyclopropanecarboxylic 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/c5-4(1-2-4)3(6)7/h1-2,5H2,(H,6,7) |
| InChIKey | PAJPWUMXBYXFCZ-UHFFFAOYSA-N |
| Molecular Weight | 101.105 g/mol |
| SMILES | NC1(C(O)=O)CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.923592 |