| SpectraBase Compound ID | Dj4qTXeqjxO |
|---|---|
| InChI | InChI=1S/C9H7ClF3NO/c10-5-8(15)14-7-3-1-6(2-4-7)9(11,12)13/h1-4H,5H2,(H,14,15) |
| InChIKey | BHXKHTOSJBCCMU-UHFFFAOYSA-N |
| Mol Weight | 237.61 g/mol |
| Molecular Formula | C9H7ClF3NO |
| Exact Mass | 237.016826 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ILgy9oXfGIu |
|---|---|
| Name | p-Acetotoluidide, 2-chloro-alpha,alpha,alpha-trifluoro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.016826037 u |
| Formula | C9H7ClF3NO |
| InChI | InChI=1S/C9H7ClF3NO/c10-5-8(15)14-7-3-1-6(2-4-7)9(11,12)13/h1-4H,5H2,(H,14,15) |
| InChIKey | BHXKHTOSJBCCMU-UHFFFAOYSA-N |
| Molecular Weight | 237.609 g/mol |
| SMILES | N(C1=CC=C(C=C1)C(F)(F)F)C(CCl)=O |