| SpectraBase Compound ID | LAEJBsmq49e |
|---|---|
| InChI | InChI=1S/C16H31NO/c1-5-7-8-9-10-11-13-17(12-6-2)16(18)14-15(3)4/h14H,5-13H2,1-4H3 |
| InChIKey | LRPKKYDBSIPQJS-UHFFFAOYSA-N |
| Mol Weight | 253.43 g/mol |
| Molecular Formula | C16H31NO |
| Exact Mass | 253.240565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FdqtQFSuAEl |
|---|---|
| Name | but-2-Enoylamide, 3-methyl-N-propyl-N-octyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.240564621 u |
| Formula | C16H31NO |
| InChI | InChI=1S/C16H31NO/c1-5-7-8-9-10-11-13-17(12-6-2)16(18)14-15(3)4/h14H,5-13H2,1-4H3 |
| InChIKey | LRPKKYDBSIPQJS-UHFFFAOYSA-N |
| Molecular Weight | 253.430 g/mol |
| SMILES | C(=O)(N(CCC)CCCCCCCC)C=C(C)C |