SpectraBase Spectrum ID |
IgI9wX38Ja6 |
Name |
N-(4-Ethylphenyl)-2-hydroxy-4-oxo-4-phenylbut-2-enamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.120843408 u |
Formula |
C18H17NO3 |
InChI |
InChI=1S/C18H17NO3/c1-2-13-8-10-15(11-9-13)19-18(22)17(21)12-16(20)14-6-4-3-5-7-14/h3-12,21H,2H2,1H3,(H,19,22)/b17-12- |
InChIKey |
ATJYXGTVJVRNAI-ATVHPVEESA-N |
SMILES |
C1=CC=C(C=C1)C(=O)\C=C\(C(NC1=CC=C(C=C1)CC)=O)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957744 |