SpectraBase Spectrum ID |
IcTbbBmVTZh |
Name |
Prop-2-en-1-yl 2-[4-(2,5-dioxopyrrol-1-yl)phenyl]acetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
271.084457899 u |
Formula |
C15H13NO4 |
InChI |
InChI=1S/C15H13NO4/c1-2-9-20-15(19)10-11-3-5-12(6-4-11)16-13(17)7-8-14(16)18/h2-8H,1,9-10H2 |
InChIKey |
BBEDXXZMABIAFS-UHFFFAOYSA-N |
SMILES |
C1(C=CC(N1C1=CC=C(C=C1)CC(=O)OCC=C)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956242 |