| SpectraBase Compound ID | E2d6dbcD17c |
|---|---|
| InChI | InChI=1S/C8H10ClNO/c1-5-3-7(10)8(11-2)4-6(5)9/h3-4H,10H2,1-2H3 |
| InChIKey | XBAPOWUMJRIKAV-UHFFFAOYSA-N |
| Mol Weight | 171.63 g/mol |
| Molecular Formula | C8H10ClNO |
| Exact Mass | 171.045092 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | D1y1LaNb1zF |
|---|---|
| Name | 4-Chloro-2-methoxy-5-methylaniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.045091645 u |
| Formula | C8H10ClNO |
| InChI | InChI=1S/C8H10ClNO/c1-5-3-7(10)8(11-2)4-6(5)9/h3-4H,10H2,1-2H3 |
| InChIKey | XBAPOWUMJRIKAV-UHFFFAOYSA-N |
| Molecular Weight | 171.627 g/mol |
| SMILES | C1=C(C(C)=CC(=C1OC)N)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.924275 |