| SpectraBase Compound ID | cgBLrGi9Q2 |
|---|---|
| InChI | InChI=1S/C17H27NO/c1-4-5-7-12-17(19)18(13-15(2)3)14-16-10-8-6-9-11-16/h6,8-11,15H,4-5,7,12-14H2,1-3H3 |
| InChIKey | XYFXJOKMCXUGNT-UHFFFAOYSA-N |
| Mol Weight | 261.41 g/mol |
| Molecular Formula | C17H27NO |
| Exact Mass | 261.209264 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2XqJI6FpCeQ |
|---|---|
| Name | Hexanamide, N-benzyl-N-isobutyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.209264492 u |
| Formula | C17H27NO |
| InChI | InChI=1S/C17H27NO/c1-4-5-7-12-17(19)18(13-15(2)3)14-16-10-8-6-9-11-16/h6,8-11,15H,4-5,7,12-14H2,1-3H3 |
| InChIKey | XYFXJOKMCXUGNT-UHFFFAOYSA-N |
| Molecular Weight | 261.409 g/mol |
| SMILES | C(N(CC(C)C)CC1=CC=CC=C1)(=O)CCCCC |