| SpectraBase Compound ID | IioPWflAv5r |
|---|---|
| InChI | InChI=1S/C16H31NO/c1-13-10-11-15(17-12-6-9-16(13)17)8-5-3-4-7-14(2)18/h13-16,18H,3-12H2,1-2H3 |
| InChIKey | MGQBKGNAHPBNRI-UHFFFAOYSA-N |
| Mol Weight | 253.43 g/mol |
| Molecular Formula | C16H31NO |
| Exact Mass | 253.240565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | M2uwjf5izB |
|---|---|
| Name | 7-((5R,8R,8as)-8-Methyloctahydroindolizin-5-yl)heptan-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.240564621 u |
| Formula | C16H31NO |
| InChI | InChI=1S/C16H31NO/c1-13-10-11-15(17-12-6-9-16(13)17)8-5-3-4-7-14(2)18/h13-16,18H,3-12H2,1-2H3 |
| InChIKey | MGQBKGNAHPBNRI-UHFFFAOYSA-N |
| Molecular Weight | 253.430 g/mol |
| SMILES | C1CC(N2C(C1C)CCC2)CCCCCC(O)C |