| SpectraBase Compound ID | ENsHJAf7ALv |
|---|---|
| InChI | InChI=1S/C18H29NO/c20-17(4-7-19-5-2-1-3-6-19)18-11-14-8-15(12-18)10-16(9-14)13-18/h14-16H,1-13H2/t14-,15+,16-,18- |
| InChIKey | SQJMUKJHIWFEFN-CMIRHGDUSA-N |
| Mol Weight | 275.44 g/mol |
| Molecular Formula | C18H29NO |
| Exact Mass | 275.224915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1VdGNXGs0Lx |
|---|---|
| Name | Propan-1-one, 1-(1-adamantyl)-3-(1-piperidyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.224914557 u |
| Formula | C18H29NO |
| InChI | InChI=1S/C18H29NO/c20-17(4-7-19-5-2-1-3-6-19)18-11-14-8-15(12-18)10-16(9-14)13-18/h14-16H,1-13H2/t14-,15+,16-,18- |
| InChIKey | SQJMUKJHIWFEFN-CMIRHGDUSA-N |
| SMILES | [C@]12(C[C@@]3(C[C@](C2)(CC(C1)(C(CCN1CCCCC1)=O)C3)[H])[H])[H] |