| SpectraBase Spectrum ID |
1kXVAuNVtEN |
| Name |
Acetamide, N-[2-oxo-1-[[(phenylmethyl)amino]methylene]propyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
232.121177761 u |
| Formula |
C13H16N2O2 |
| InChI |
InChI=1S/C13H16N2O2/c1-10(16)13(15-11(2)17)9-14-8-12-6-4-3-5-7-12/h3-7,9,14H,8H2,1-2H3,(H,15,17)/b13-9+ |
| InChIKey |
SGFVQDOQFYXMPJ-UKTHLTGXSA-N |
| Molecular Weight |
232.283 g/mol |
| SMILES |
C(N\C(C(=O)C)=C/NCC=1C=CC=CC1)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967045 |