| SpectraBase Compound ID | 50SiODUqMHW |
|---|---|
| InChI | InChI=1S/C16H33NO/c1-6-8-9-10-12-17(15(5)11-7-2)16(18)13-14(3)4/h14-15H,6-13H2,1-5H3 |
| InChIKey | LEZKJFCPRKXLDP-UHFFFAOYSA-N |
| Mol Weight | 255.4 g/mol |
| Molecular Formula | C16H33NO |
| Exact Mass | 255.256215 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7rpuVSyEx36 |
|---|---|
| Name | Isovaleramide, N-(2-pentyl)-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.256214686 u |
| Formula | C16H33NO |
| InChI | InChI=1S/C16H33NO/c1-6-8-9-10-12-17(15(5)11-7-2)16(18)13-14(3)4/h14-15H,6-13H2,1-5H3 |
| InChIKey | LEZKJFCPRKXLDP-UHFFFAOYSA-N |
| Molecular Weight | 255.446 g/mol |
| SMILES | C(N(CCCCCC)C(CCC)C)(=O)CC(C)C |