| SpectraBase Spectrum ID |
AufMBxkNL0K |
| Name |
1,3-Dioxane-4,6-dione, 5-[(diethylamino)methylene]-2,2-dimethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
227.115758027 u |
| Formula |
C11H17NO4 |
| InChI |
InChI=1S/C11H17NO4/c1-5-12(6-2)7-8-9(13)15-11(3,4)16-10(8)14/h7H,5-6H2,1-4H3 |
| InChIKey |
ADAAHUKPKOQXKO-UHFFFAOYSA-N |
| Molecular Weight |
227.260 g/mol |
| SMILES |
C1(C(OC(OC1=O)(C)C)=O)=CN(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916543 |
![1,3-Dioxane-4,6-dione, 5-[(diethylamino)methylene]-2,2-dimethyl-](/api/spectrum/AufMBxkNL0K/structure.png?h=300&w=458 "1,3-Dioxane-4,6-dione, 5-[(diethylamino)methylene]-2,2-dimethyl-")
