| SpectraBase Spectrum ID |
DLLeIRcaK8y |
| Name |
Tetraethyl 1,2,2A,7-tetrahydrocyclopenta[C]pyridazin-1,2,6,6-tetracarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
412.184565862 u |
| Formula |
C19H28N2O8 |
| InChI |
InChI=1S/C19H28N2O8/c1-5-26-15(22)19(16(23)27-6-2)11-13-9-10-20(17(24)28-7-3)21(14(13)12-19)18(25)29-8-4/h9,14H,5-8,10-12H2,1-4H3 |
| InChIKey |
JGFNRNINXFFQPR-UHFFFAOYSA-N |
| Molecular Weight |
412.439 g/mol |
| SMILES |
C1(CC2N(N(C(=O)OCC)CC=C2C1)C(=O)OCC)(C(=O)OCC)C(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.853922 |
![Tetraethyl 1,2,2a,7-tetrahydrocyclopenta[c]pyridazin-1,2,6,6-tetracarboxylate](/api/spectrum/DLLeIRcaK8y/structure.png?h=300&w=458 "Tetraethyl 1,2,2a,7-tetrahydrocyclopenta[c]pyridazin-1,2,6,6-tetracarboxylate")
