| SpectraBase Compound ID | A9FqPEED31l |
|---|---|
| InChI | InChI=1S/C18H29NO/c1-3-5-7-19(6-4-2)17(20)18-11-14-8-15(12-18)10-16(9-14)13-18/h4,14-16H,2-3,5-13H2,1H3/t14-,15+,16-,18- |
| InChIKey | PXEVRRJGZNDLPZ-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 | 91hcKtwAZKG |
|---|---|
| Name | Adamantane-1-carboxamide, N-allyl-N-butyl- |
| 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/c1-3-5-7-19(6-4-2)17(20)18-11-14-8-15(12-18)10-16(9-14)13-18/h4,14-16H,2-3,5-13H2,1H3/t14-,15+,16-,18- |
| InChIKey | PXEVRRJGZNDLPZ-CMIRHGDUSA-N |
| SMILES | C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(CCCC)CC=C)=O |