| SpectraBase Compound ID | L3mZxrMvL3z |
|---|---|
| InChI | InChI=1S/C7H8ClN/c1-5-4-6(8)2-3-7(5)9/h2-4H,9H2,1H3 |
| InChIKey | CXNVOWPRHWWCQR-UHFFFAOYSA-N |
| Mol Weight | 141.6 g/mol |
| Molecular Formula | C7H8ClN |
| Exact Mass | 141.034527 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9aX6sycOdzN |
|---|---|
| Name | 4-Chloro-o-toluidine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 141.034526962 u |
| Formula | C7H8ClN |
| InChI | InChI=1S/C7H8ClN/c1-5-4-6(8)2-3-7(5)9/h2-4H,9H2,1H3 |
| InChIKey | CXNVOWPRHWWCQR-UHFFFAOYSA-N |
| Molecular Weight | 141.601 g/mol |
| SMILES | NC1=C(C=C(C=C1)Cl)C |
| Spectrum/Structure Validation Score (Raman) | 0.87711 |