| SpectraBase Compound ID | DyRoxtFvQS8 |
|---|---|
| InChI | InChI=1S/C16H22N2O2/c1-3-18-11-5-4-6-14(16(18)20)17-15(19)13-9-7-12(2)8-10-13/h7-10,14H,3-6,11H2,1-2H3,(H,17,19) |
| InChIKey | JAQTWQGUTLPOLH-UHFFFAOYSA-N |
| Mol Weight | 274.36 g/mol |
| Molecular Formula | C16H22N2O2 |
| Exact Mass | 274.168128 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 52DLPDRzQXC |
|---|---|
| Name | N-(1-Ethyl-2-oxoazepan-3-yl)-4-methylbenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.168127954 u |
| Formula | C16H22N2O2 |
| InChI | InChI=1S/C16H22N2O2/c1-3-18-11-5-4-6-14(16(18)20)17-15(19)13-9-7-12(2)8-10-13/h7-10,14H,3-6,11H2,1-2H3,(H,17,19) |
| InChIKey | JAQTWQGUTLPOLH-UHFFFAOYSA-N |
| SMILES | C(C1=CC=C(C=C1)C)(=O)NC1C(N(CCCC1)CC)=O |