| SpectraBase Spectrum ID |
2vnynkkOAyU |
| Name |
(2R,3S)-3-(Hydroxymethyl)-2-oxiranecarboxamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
117.042593086 u |
| Formula |
C4H7NO3 |
| InChI |
InChI=1S/C4H7NO3/c5-4(7)3-2(1-6)8-3/h2-3,6H,1H2,(H2,5,7)/t2-,3+/m0/s1 |
| InChIKey |
OEYNCQONTYEYKI-STHAYSLISA-N |
| Molecular Weight |
117.104 g/mol |
| SMILES |
[C@@]1(O[C@]1(CO)[H])(C(=O)N)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864114 |
