| SpectraBase Compound ID | JGhVI2qXvpf |
|---|---|
| InChI | InChI=1S/C4H7NO2/c6-4-1-2-5(7)3-4/h3-4,6H,1-2H2/t4-/m0/s1 |
| InChIKey | KOCUONUIHIZTMY-BYPYZUCNSA-N |
| Mol Weight | 101.1 g/mol |
| Molecular Formula | C4H7NO2 |
| Exact Mass | 101.047678 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | COQnW410slF |
|---|---|
| Name | (3S)-1-Oxido-1-pyrrolin-1-ium-3-ol |
| 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/c6-4-1-2-5(7)3-4/h3-4,6H,1-2H2/t4-/m0/s1 |
| InChIKey | KOCUONUIHIZTMY-BYPYZUCNSA-N |
| Molecular Weight | 101.105 g/mol |
| SMILES | C1=[N+](CC[C@@]1(O)[H])[O-] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962004 |