| SpectraBase Compound ID | 90zFBZXd6eD |
|---|---|
| InChI | InChI=1S/C17H26N2O/c1-14-7-8-15(2)16(13-14)18-17(20)9-12-19-10-5-3-4-6-11-19/h7-8,13H,3-6,9-12H2,1-2H3,(H,18,20) |
| InChIKey | CIXVXDGXKMAGHG-UHFFFAOYSA-N |
| Mol Weight | 274.41 g/mol |
| Molecular Formula | C17H26N2O |
| Exact Mass | 274.204513 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ICyEzNfMuWJ |
|---|---|
| Name | 1H-Azepine-1-propanamide, N-(2,5-dimethylphenyl)hexahydro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.204513464 u |
| Formula | C17H26N2O |
| InChI | InChI=1S/C17H26N2O/c1-14-7-8-15(2)16(13-14)18-17(20)9-12-19-10-5-3-4-6-11-19/h7-8,13H,3-6,9-12H2,1-2H3,(H,18,20) |
| InChIKey | CIXVXDGXKMAGHG-UHFFFAOYSA-N |
| Molecular Weight | 274.408 g/mol |
| SMILES | N(C1=C(C=CC(=C1)C)C)C(CCN1CCCCCC1)=O |