| SpectraBase Compound ID | HzvphMzh3Fc |
|---|---|
| InChI | InChI=1S/C15H10ClNO2/c1-7-6-10(16)11-12(13(7)17)15(19)9-5-3-2-4-8(9)14(11)18/h2-6H,17H2,1H3 |
| InChIKey | XHWWVXZEALFXQA-UHFFFAOYSA-N |
| Mol Weight | 271.7 g/mol |
| Molecular Formula | C15H10ClNO2 |
| Exact Mass | 271.040006 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | GQVrxOfoQls |
|---|---|
| Name | 1-Amino-4-chloro-2-methylanthraquinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.040006264 u |
| Formula | C15H10ClNO2 |
| InChI | InChI=1S/C15H10ClNO2/c1-7-6-10(16)11-12(13(7)17)15(19)9-5-3-2-4-8(9)14(11)18/h2-6H,17H2,1H3 |
| InChIKey | XHWWVXZEALFXQA-UHFFFAOYSA-N |
| SMILES | NC1=C(C=C(C=2C(C=3C=CC=CC3C(C12)=O)=O)Cl)C |
| Spectrum/Structure Validation Score (Raman) | 0.786495 |