| SpectraBase Compound ID | GJ66D52DhZV |
|---|---|
| InChI | InChI=1S/C18H29NO/c1-4-5-19(12-13(2)3)17(20)18-9-14-6-15(10-18)8-16(7-14)11-18/h4,13-16H,1,5-12H2,2-3H3/t14-,15+,16-,18- |
| InChIKey | IKEMPXLPIDJRLF-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 | BrBnauf7LGZ |
|---|---|
| Name | Adamantane-1-carboxamide, N-allyl-N-isobutyl- |
| 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/c1-4-5-19(12-13(2)3)17(20)18-9-14-6-15(10-18)8-16(7-14)11-18/h4,13-16H,1,5-12H2,2-3H3/t14-,15+,16-,18- |
| InChIKey | IKEMPXLPIDJRLF-CMIRHGDUSA-N |
| SMILES | C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(CC(C)C)CC=C)=O |