| SpectraBase Compound ID | 2I8AAd4mNz8 |
|---|---|
| InChI | InChI=1S/C19H29N3O/c1-4-22-13(3)17(12(2)21-22)18(23)20-11-19-8-14-5-15(9-19)7-16(6-14)10-19/h14-16H,4-11H2,1-3H3,(H,20,23) |
| InChIKey | XDEVPQRVBMDCSC-UHFFFAOYSA-N |
| Mol Weight | 315.46 g/mol |
| Molecular Formula | C19H29N3O |
| Exact Mass | 315.231063 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2v7WcGGWkk1 |
|---|---|
| Name | N-(1-Adamantylmethyl)-1-ethyl-3,5-dimethyl-1H-pyrazole-4-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.231062565 u |
| Formula | C19H29N3O |
| InChI | InChI=1S/C19H29N3O/c1-4-22-13(3)17(12(2)21-22)18(23)20-11-19-8-14-5-15(9-19)7-16(6-14)10-19/h14-16H,4-11H2,1-3H3,(H,20,23) |
| InChIKey | XDEVPQRVBMDCSC-UHFFFAOYSA-N |
| SMILES | N(CC12CC3CC(C2)CC(C1)C3)C(C=1C(=NN(C1C)CC)C)=O |