| SpectraBase Spectrum ID |
5hMkdS8pSPw |
| Name |
N,N,N'-Triacetyl-2,5-dichlorobenzene-1,4-diamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
302.022497651 u |
| Formula |
C12H12Cl2N2O3 |
| InChI |
InChI=1S/C12H12Cl2N2O3/c1-6(17)15-11-4-10(14)12(5-9(11)13)16(7(2)18)8(3)19/h4-5H,1-3H3,(H,15,17) |
| InChIKey |
AUAIWAHQEFNMOD-UHFFFAOYSA-N |
| Molecular Weight |
303.145 g/mol |
| SMILES |
C1(Cl)=C(C=C(C(=C1)NC(C)=O)Cl)N(C(C)=O)C(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864504 |
