| SpectraBase Spectrum ID |
Jr40qkN0kUT |
| Name |
2-Propenamide, N,N-diacetyl-3-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
231.089543280 u |
| Formula |
C13H13NO3 |
| InChI |
InChI=1S/C13H13NO3/c1-10(15)14(11(2)16)13(17)9-8-12-6-4-3-5-7-12/h3-9H,1-2H3/b9-8+ |
| InChIKey |
OAICXKMEAGQRES-CMDGGOBGSA-N |
| Molecular Weight |
231.251 g/mol |
| SMILES |
C(N(C(=O)C)C(=O)C)(\C=C\C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.986063 |
