SpectraBase Compound ID | 93x9sON513E |
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InChI | InChI=1S/C9H10ClNO/c1-7-4-2-3-5-8(7)11-9(12)6-10/h2-5H,6H2,1H3,(H,11,12) |
InChIKey | LPMANECYGPQBOX-UHFFFAOYSA-N |
Mol Weight | 183.64 g/mol |
Molecular Formula | C9H10ClNO |
Exact Mass | 183.045092 g/mol |
SpectraBase Spectrum ID | HzO8DsvVHmv |
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Name | 2-Chloro-o-acetotoluidide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 183.045091645 u |
Formula | C9H10ClNO |
InChI | InChI=1S/C9H10ClNO/c1-7-4-2-3-5-8(7)11-9(12)6-10/h2-5H,6H2,1H3,(H,11,12) |
InChIKey | LPMANECYGPQBOX-UHFFFAOYSA-N |
Molecular Weight | 183.638 g/mol |
SMILES | N(C1=C(C=CC=C1)C)C(CCl)=O |
Spectrum/Structure Validation Score (Raman) | 0.722858 |