| SpectraBase Spectrum ID |
KWSFIKHzdgM |
| Name |
N,N'-Dimethyl-2,4-dinitrobenzylidenemalonamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.075684116 u |
| Formula |
C12H12N4O6 |
| InChI |
InChI=1S/C12H12N4O6/c1-13-11(17)9(12(18)14-2)5-7-3-4-8(15(19)20)6-10(7)16(21)22/h3-6H,1-2H3,(H,13,17)(H,14,18) |
| InChIKey |
SEXXAIIJLNWBQJ-UHFFFAOYSA-N |
| Molecular Weight |
308.250 g/mol |
| SMILES |
C(C(C(=O)NC)=CC=1C(=CC(=CC1)N(=O)=O)N(=O)=O)(=O)NC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973204 |
