| SpectraBase Compound ID | IT9ceF0N87V |
|---|---|
| InChI | InChI=1S/C18H26N2/c1-2-3-4-5-6-8-14-20-15-9-7-12-18(20)17-11-10-13-19-16-17/h10-11,13,16,18H,2-5,7,9,12,14-15H2,1H3 |
| InChIKey | LFGKVBBGXRWEQI-UHFFFAOYSA-N |
| Mol Weight | 270.42 g/mol |
| Molecular Formula | C18H26N2 |
| Exact Mass | 270.209599 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LGjGGFJJ01z |
|---|---|
| Name | (2S)-1-(2-Octynyl)-2-(3-pyridinyl)piperidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.209598845 u |
| Formula | C18H26N2 |
| InChI | InChI=1S/C18H26N2/c1-2-3-4-5-6-8-14-20-15-9-7-12-18(20)17-11-10-13-19-16-17/h10-11,13,16,18H,2-5,7,9,12,14-15H2,1H3 |
| InChIKey | LFGKVBBGXRWEQI-UHFFFAOYSA-N |
| Molecular Weight | 270.420 g/mol |
| SMILES | CCCCCC#CCN1C(C=2C=NC=CC2)CCCC1 |