| SpectraBase Spectrum ID |
AkzwPgnh4Ni |
| Name |
p-(2,4-Dinitroanilino)phenyl acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
317.064785080 u |
| Formula |
C14H11N3O6 |
| InChI |
InChI=1S/C14H11N3O6/c1-9(18)23-12-5-2-10(3-6-12)15-13-7-4-11(16(19)20)8-14(13)17(21)22/h2-8,15H,1H3 |
| InChIKey |
FOUPFNMDERAHIZ-UHFFFAOYSA-N |
| Molecular Weight |
317.257 g/mol |
| SMILES |
C1(=CC=C(C=C1)OC(=O)C)NC1=CC=C(N(=O)=O)C=C1N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947738 |
