| SpectraBase Compound ID | 96uHSSzaure |
|---|---|
| InChI | InChI=1S/C3H7N.Cl/c1-2-4-3-1;/h4H,1-3H2; |
| InChIKey | ACJGRGKJRDNGOB-UHFFFAOYSA-N |
| Mol Weight | 92.55 g/mol |
| Molecular Formula | C3H7ClN |
| Exact Mass | 92.026702 g/mol |
| SpectraBase Spectrum ID | GNkJGm3AC2q |
|---|---|
| Name | Azetidine hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 92.026701929 u |
| Formula | C3H7ClN |
| InChI | InChI=1S/C3H7N.Cl/c1-2-4-3-1;/h4H,1-3H2; |
| InChIKey | ACJGRGKJRDNGOB-UHFFFAOYSA-N |
| Molecular Weight | 92.549 g/mol |
| Nominal Mass | 92 u |
| SMILES | C1NCC1.[Cl] |
| Spectrum/Structure Validation Score (Raman) | 0.936517 |