| SpectraBase Compound ID | F6WxYmqLEMQ |
|---|---|
| InChI | InChI=1S/C12H16ClNO/c1-4-9(2)14(3)12(15)10-7-5-6-8-11(10)13/h5-9H,4H2,1-3H3 |
| InChIKey | GGWHSBRWIGUUNQ-UHFFFAOYSA-N |
| Mol Weight | 225.72 g/mol |
| Molecular Formula | C12H16ClNO |
| Exact Mass | 225.092042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 94LTub2DNhE |
|---|---|
| Name | Benzamide, 2-chloro-N-(2-butyl)-N-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.092041838 u |
| Formula | C12H16ClNO |
| InChI | InChI=1S/C12H16ClNO/c1-4-9(2)14(3)12(15)10-7-5-6-8-11(10)13/h5-9H,4H2,1-3H3 |
| InChIKey | GGWHSBRWIGUUNQ-UHFFFAOYSA-N |
| Molecular Weight | 225.719 g/mol |
| SMILES | C(N(C)C(CC)C)(=O)C=1C(Cl)=CC=CC1 |