| SpectraBase Compound ID | GznoNa01If6 |
|---|---|
| InChI | InChI=1S/C20H31NO/c1-4-6-7-8-12-16-21(20(22)18(3)13-5-2)17-19-14-10-9-11-15-19/h5,9-11,14-15,18H,2,4,6-8,12-13,16-17H2,1,3H3 |
| InChIKey | ZUMJOFAQXNYCCX-UHFFFAOYSA-N |
| Mol Weight | 301.47 g/mol |
| Molecular Formula | C20H31NO |
| Exact Mass | 301.240565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LVBT58l0ll3 |
|---|---|
| Name | Pent-4-enoylamide, 2-methyl-N-benzyl-N-heptyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.240564621 u |
| Formula | C20H31NO |
| InChI | InChI=1S/C20H31NO/c1-4-6-7-8-12-16-21(20(22)18(3)13-5-2)17-19-14-10-9-11-15-19/h5,9-11,14-15,18H,2,4,6-8,12-13,16-17H2,1,3H3 |
| InChIKey | ZUMJOFAQXNYCCX-UHFFFAOYSA-N |
| SMILES | C(N(CCCCCCC)CC1=CC=CC=C1)(=O)C(CC=C)C |