| SpectraBase Compound ID | 1z1mf0DMmFM |
|---|---|
| InChI | InChI=1S/C21H39N/c1-4-7-9-11-12-13-15-17-21-19-18-20(22(21)6-3)16-14-10-8-5-2/h4-5,20-21H,1-2,6-19H2,3H3 |
| InChIKey | DLNITPLUNNVSMW-UHFFFAOYSA-N |
| Mol Weight | 305.6 g/mol |
| Molecular Formula | C21H39N |
| Exact Mass | 305.30825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5knZTiiE23 |
|---|---|
| Name | 1-Ethyl-2-(5-hexenyl)-5-(8-nonenyl)pyrrolidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.308250260 u |
| Formula | C21H39N |
| InChI | InChI=1S/C21H39N/c1-4-7-9-11-12-13-15-17-21-19-18-20(22(21)6-3)16-14-10-8-5-2/h4-5,20-21H,1-2,6-19H2,3H3 |
| InChIKey | DLNITPLUNNVSMW-UHFFFAOYSA-N |
| Molecular Weight | 305.550 g/mol |
| SMILES | C1(N(C(CC1)CCCCC=C)CC)CCCCCCCC=C |