SpectraBase Spectrum ID |
FudXkdD32uB |
Name |
1,4,7,10-Tetraazatricyclo[8.2.1.1(4,7)]tetradecane-13,14-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
224.127325769 u |
Formula |
C10H16N4O2 |
InChI |
InChI=1S/C10H16N4O2/c15-9-11-1-2-12(9)7-8-14-4-3-13(6-5-11)10(14)16/h1-8H2 |
InChIKey |
FGRKJYIMJUSYBU-UHFFFAOYSA-N |
Molecular Weight |
224.264 g/mol |
SMILES |
C1(N2CCN3CCN(C3=O)CCN1CC2)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977835 |