| SpectraBase Spectrum ID |
DJ4hillSmZo |
| Name |
1-Cyclohexenyl-2-morpholinoethane-1,2-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
223.120843408 u |
| Formula |
C12H17NO3 |
| InChI |
InChI=1S/C12H17NO3/c14-11(10-4-2-1-3-5-10)12(15)13-6-8-16-9-7-13/h4H,1-3,5-9H2 |
| InChIKey |
GVNZHSAFGSYFFV-UHFFFAOYSA-N |
| Molecular Weight |
223.272 g/mol |
| SMILES |
C(C(C1=CCCCC1)=O)(N1CCOCC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.984853 |