| SpectraBase Compound ID | 9Hcll7t5ROM |
|---|---|
| InChI | InChI=1S/C14H12ClNO/c1-10-7-8-12(15)9-13(10)16-14(17)11-5-3-2-4-6-11/h2-9H,1H3,(H,16,17) |
| InChIKey | MZQJQFDXYQRRMI-UHFFFAOYSA-N |
| Mol Weight | 245.71 g/mol |
| Molecular Formula | C14H12ClNO |
| Exact Mass | 245.060742 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Df31emd9P4y |
|---|---|
| Name | 5'-Chloro-o-benzotoluidide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.060741709 u |
| Formula | C14H12ClNO |
| InChI | InChI=1S/C14H12ClNO/c1-10-7-8-12(15)9-13(10)16-14(17)11-5-3-2-4-6-11/h2-9H,1H3,(H,16,17) |
| InChIKey | MZQJQFDXYQRRMI-UHFFFAOYSA-N |
| Molecular Weight | 245.709 g/mol |
| SMILES | N(C1=CC(Cl)=CC=C1C)C(C=1C=CC=CC1)=O |