| SpectraBase Compound ID | 3fzQ2GTUWPQ |
|---|---|
| InChI | InChI=1S/C12H23NO/c1-4-5-6-7-8-9-12(14)13-10-11(2)3/h2,4-10H2,1,3H3,(H,13,14) |
| InChIKey | RPDGRFNHPPRPQB-UHFFFAOYSA-N |
| Mol Weight | 197.32 g/mol |
| Molecular Formula | C12H23NO |
| Exact Mass | 197.177964 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Iz8H3CmGPEb |
|---|---|
| Name | Octanamide, N-methallyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.177964364 u |
| Formula | C12H23NO |
| InChI | InChI=1S/C12H23NO/c1-4-5-6-7-8-9-12(14)13-10-11(2)3/h2,4-10H2,1,3H3,(H,13,14) |
| InChIKey | RPDGRFNHPPRPQB-UHFFFAOYSA-N |
| Molecular Weight | 197.322 g/mol |
| SMILES | C(CCCCC)CC(=O)NCC(=C)C |