| SpectraBase Compound ID | 5C7VNhV45px |
|---|---|
| InChI | InChI=1S/C21H39NO/c1-6-8-9-10-11-12-13-14-16-21(23)22(18-17-19(3)4)20(5)15-7-2/h1,19-20H,7-18H2,2-5H3 |
| InChIKey | LHAATINBOMDZRT-UHFFFAOYSA-N |
| Mol Weight | 321.5 g/mol |
| Molecular Formula | C21H39NO |
| Exact Mass | 321.303165 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kv7ZxVR1ShD |
|---|---|
| Name | Undec-10-ynoylamide, N-(2-pentyl)-N-(3-methylbutyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 321.303164879 u |
| Formula | C21H39NO |
| InChI | InChI=1S/C21H39NO/c1-6-8-9-10-11-12-13-14-16-21(23)22(18-17-19(3)4)20(5)15-7-2/h1,19-20H,7-18H2,2-5H3 |
| InChIKey | LHAATINBOMDZRT-UHFFFAOYSA-N |
| Molecular Weight | 321.549 g/mol |
| SMILES | CCCC(N(C(=O)CCCCCCCCC#C)CCC(C)C)C |