SpectraBase Spectrum ID |
E7hcjIq7NfC |
Name |
2-[(5-Methyl-2,6-dioxomorpholin-3-yl)methyl]isoindole-1,3-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
288.074621489 u |
Formula |
C14H12N2O5 |
InChI |
InChI=1S/C14H12N2O5/c1-7-13(19)21-14(20)10(15-7)6-16-11(17)8-4-2-3-5-9(8)12(16)18/h2-5,7,10,15H,6H2,1H3 |
InChIKey |
DFJOMDAKOJBEKX-UHFFFAOYSA-N |
SMILES |
C(C1C(OC(C(N1)C)=O)=O)N1C(=O)C2=CC=CC=C2C1=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.86399 |