| SpectraBase Compound ID | JsrigblU1lo |
|---|---|
| InChI | InChI=1S/C15H10Cl2N2O/c16-13-6-3-11(9-14(13)17)15(20)19-12-4-1-10(2-5-12)7-8-18/h1-6,9H,7H2,(H,19,20) |
| InChIKey | RLYLWAQJILPZNE-UHFFFAOYSA-N |
| Mol Weight | 305.16 g/mol |
| Molecular Formula | C15H10Cl2N2O |
| Exact Mass | 304.017018 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HbV28R5vToI |
|---|---|
| Name | Benzamide, 3,4-dichloro-N-(4-cyanomethylphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.017018349 u |
| Formula | C15H10Cl2N2O |
| InChI | InChI=1S/C15H10Cl2N2O/c16-13-6-3-11(9-14(13)17)15(20)19-12-4-1-10(2-5-12)7-8-18/h1-6,9H,7H2,(H,19,20) |
| InChIKey | RLYLWAQJILPZNE-UHFFFAOYSA-N |
| Molecular Weight | 305.164 g/mol |
| SMILES | C(C1=CC(Cl)=C(C=C1)Cl)(NC1=CC=C(CC#N)C=C1)=O |