| SpectraBase Spectrum ID |
Ff7mtobm0FD |
| Name |
Trans-N,N-diethyl-3-(3-pyridyl)-2,3-epoxypropionamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.121177761 u |
| Formula |
C12H16N2O2 |
| InChI |
InChI=1S/C12H16N2O2/c1-3-14(4-2)12(15)11-10(16-11)9-6-5-7-13-8-9/h5-8,10-11H,3-4H2,1-2H3/t10-,11+/m1/s1 |
| InChIKey |
OXUBIJXEEDLIGL-MNOVXSKESA-N |
| Molecular Weight |
220.272 g/mol |
| SMILES |
[C@]1(O[C@@]1(C=1C=NC=CC1)[H])(C(N(CC)CC)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940005 |
