| SpectraBase Spectrum ID |
KP8Rr3CF9tg |
| Name |
2,2-Dimethyl-5-{[(4-chloro-2-methylphenyl)amino]methylene}-1,3-dioxane-4,6-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
295.061135631 u |
| Formula |
C14H14ClNO4 |
| InChI |
InChI=1S/C14H14ClNO4/c1-8-6-9(15)4-5-11(8)16-7-10-12(17)19-14(2,3)20-13(10)18/h4-7,16H,1-3H3 |
| InChIKey |
AHHCRBKWOAHUIA-UHFFFAOYSA-N |
| Molecular Weight |
295.722 g/mol |
| SMILES |
C1(C(OC(OC1=O)(C)C)=O)=CNC=1C(=CC(=CC1)Cl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.871044 |
![2,2-Dimethyl-5-{[(4-chloro-2-methylphenyl)amino]methylene}-1,3-dioxane-4,6-dione](/api/spectrum/KP8Rr3CF9tg/structure.png?h=300&w=458 "2,2-Dimethyl-5-{[(4-chloro-2-methylphenyl)amino]methylene}-1,3-dioxane-4,6-dione")
