| SpectraBase Compound ID | I9KlwCS3Sa7 |
|---|---|
| InChI | InChI=1S/C18H20ClNO/c1-14(2)12-20(13-15-8-4-3-5-9-15)18(21)16-10-6-7-11-17(16)19/h3-11,14H,12-13H2,1-2H3 |
| InChIKey | GXHVNHXGSGAMRZ-UHFFFAOYSA-N |
| Mol Weight | 301.82 g/mol |
| Molecular Formula | C18H20ClNO |
| Exact Mass | 301.123342 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1s7csQYFAzu |
|---|---|
| Name | Benzamide, 2-chloro-N-benzyl-N-isobutyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.123341967 u |
| Formula | C18H20ClNO |
| InChI | InChI=1S/C18H20ClNO/c1-14(2)12-20(13-15-8-4-3-5-9-15)18(21)16-10-6-7-11-17(16)19/h3-11,14H,12-13H2,1-2H3 |
| InChIKey | GXHVNHXGSGAMRZ-UHFFFAOYSA-N |
| SMILES | C(N(CC(C)C)CC1=CC=CC=C1)(=O)C=1C(Cl)=CC=CC1 |