SpectraBase Spectrum ID |
Gwdtw7t093s |
Name |
(E)-3-Hydroxy-5-[1-(ethoxycarbonyl)ethylidene]-1-phenyl-2,5-dihydropyrrol-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
273.100107963 u |
Formula |
C15H15NO4 |
InChI |
InChI=1S/C15H15NO4/c1-3-20-15(19)10(2)12-9-13(17)14(18)16(12)11-7-5-4-6-8-11/h4-9,17H,3H2,1-2H3/b12-10+ |
InChIKey |
WTBUBHODHLSSIK-ZRDIBKRKSA-N |
SMILES |
C1(N(\C(C=C1O)=C\(C)C(=O)OCC)C=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828476 |