| SpectraBase Spectrum ID |
8jRpNJAWIpA |
| Name |
2',3'-Dichloro-2-methyl-2-(2,4,5-trichlorophenoxy)propionanilide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
424.931067128 u |
| Formula |
C16H12Cl5NO2 |
| InChI |
InChI=1S/C16H12Cl5NO2/c1-16(2,24-13-7-10(19)9(18)6-11(13)20)15(23)22-12-5-3-4-8(17)14(12)21/h3-7H,1-2H3,(H,22,23) |
| InChIKey |
ZNLIQCBWAXNJOI-UHFFFAOYSA-N |
| Molecular Weight |
427.542 g/mol |
| SMILES |
N(C(C(C)(OC=1C=C(C(=CC1Cl)Cl)Cl)C)=O)C=1C=CC=C(C1Cl)Cl |
| Spectrum/Structure Validation Score (Raman) |
0.921785 |
