| SpectraBase Compound ID | 1qK5PR5fibj |
|---|---|
| InChI | InChI=1S/C13H8Cl3NO/c14-9-4-1-3-8(7-9)13(18)17-12-10(15)5-2-6-11(12)16/h1-7H,(H,17,18) |
| InChIKey | JRUYITJBRSEVJP-UHFFFAOYSA-N |
| Mol Weight | 300.57 g/mol |
| Molecular Formula | C13H8Cl3NO |
| Exact Mass | 298.967147 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Ib1iqNochvx |
|---|---|
| Name | 2',3,6'-Trichlorobenzanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.967146981 u |
| Formula | C13H8Cl3NO |
| InChI | InChI=1S/C13H8Cl3NO/c14-9-4-1-3-8(7-9)13(18)17-12-10(15)5-2-6-11(12)16/h1-7H,(H,17,18) |
| InChIKey | JRUYITJBRSEVJP-UHFFFAOYSA-N |
| SMILES | N(C1=C(C=CC=C1Cl)Cl)C(C=1C=C(C=CC1)Cl)=O |
| Spectrum/Structure Validation Score (Raman) | 0.749752 |