| SpectraBase Compound ID | CDBNrBMzBz4 |
|---|---|
| InChI | InChI=1S/C18H17Cl2NO2/c1-2-3-12-21(17(22)13-8-4-6-10-15(13)19)18(23)14-9-5-7-11-16(14)20/h4-11H,2-3,12H2,1H3 |
| InChIKey | BTPRRLZCSRYLPF-UHFFFAOYSA-N |
| Mol Weight | 350.25 g/mol |
| Molecular Formula | C18H17Cl2NO2 |
| Exact Mass | 349.063634 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9H9KPGV1UTl |
|---|---|
| Name | Benzamide, 2-chloro-N-(2-chlorobenzoyl)-N-butyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 349.063634189 u |
| Formula | C18H17Cl2NO2 |
| InChI | InChI=1S/C18H17Cl2NO2/c1-2-3-12-21(17(22)13-8-4-6-10-15(13)19)18(23)14-9-5-7-11-16(14)20/h4-11H,2-3,12H2,1H3 |
| InChIKey | BTPRRLZCSRYLPF-UHFFFAOYSA-N |
| Molecular Weight | 350.245 g/mol |
| SMILES | C(N(CCCC)C(C1=C(C=CC=C1)Cl)=O)(=O)C=1C=CC=CC1Cl |