SpectraBase Compound ID | Lvl3eyFa1ev |
---|---|
InChI | InChI=1S/C5H11NO/c7-5-1-2-6-3-4-6/h7H,1-5H2 |
InChIKey | MGDSRXCBGQRITM-UHFFFAOYSA-N |
Mol Weight | 101.15 g/mol |
Molecular Formula | C5H11NO |
Exact Mass | 101.084064 g/mol |
SpectraBase Spectrum ID | CQ7GSLqjDgP |
---|---|
Name | 1-[3-Hydroxypropyl]-aziridine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 101.084063977 u |
Formula | C5H11NO |
InChI | InChI=1S/C5H11NO/c7-5-1-2-6-3-4-6/h7H,1-5H2 |
InChIKey | MGDSRXCBGQRITM-UHFFFAOYSA-N |
Molecular Weight | 101.149 g/mol |
SMILES | C1CN1CCCO |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.903137 |