| SpectraBase Spectrum ID |
LqOuJSchgff |
| Name |
4-oxa-1-Azatricyclo[7.3.1.0(9,13)]trideca-5,7,9(13)-triene-2,3-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
203.058243151 u |
| Formula |
C11H9NO3 |
| InChI |
InChI=1S/C11H9NO3/c13-10-11(14)15-8-5-1-3-7-4-2-6-12(10)9(7)8/h1,3,5H,2,4,6H2 |
| InChIKey |
MCBCCWVUXPQNBD-UHFFFAOYSA-N |
| Molecular Weight |
203.197 g/mol |
| SMILES |
C1(OC2=C3C(CCCN3C1=O)=CC=C2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975847 |
![4-oxa-1-Azatricyclo[7.3.1.0(9,13)]trideca-5,7,9(13)-triene-2,3-dione](/api/spectrum/LqOuJSchgff/structure.png?h=300&w=458 "4-oxa-1-Azatricyclo[7.3.1.0(9,13)]trideca-5,7,9(13)-triene-2,3-dione")
