| SpectraBase Spectrum ID |
1SHqcT311mM |
| Name |
2(3H)-Furanone-5-carboxamide, N-(2'-acetylphenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.084457899 u |
| Formula |
C13H13NO4 |
| InChI |
InChI=1S/C13H13NO4/c1-8(15)9-4-2-3-5-10(9)14-13(17)11-6-7-12(16)18-11/h2-5,11H,6-7H2,1H3,(H,14,17) |
| InChIKey |
ORUROEXXJBSJLH-UHFFFAOYSA-N |
| Molecular Weight |
247.250 g/mol |
| SMILES |
C1=CC=C(C(=C1)NC(=O)C1CCC(=O)O1)C(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878354 |
