| SpectraBase Compound ID | BYeYPQzq2b5 |
|---|---|
| InChI | InChI=1S/C13H22N2O/c1-15(2)12(16)14-13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,3-8H2,1-2H3,(H,14,16)/t9-,10+,11-,13- |
| InChIKey | HPPZYQZGRIYOKL-DNSLJTBWSA-N |
| Mol Weight | 222.33 g/mol |
| Molecular Formula | C13H22N2O |
| Exact Mass | 222.173213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | QE7kHSQoVR |
|---|---|
| Name | 3-(1-Adamantyl)-1,1-dimethylurea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.173213335 u |
| Formula | C13H22N2O |
| InChI | InChI=1S/C13H22N2O/c1-15(2)12(16)14-13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,3-8H2,1-2H3,(H,14,16)/t9-,10+,11-,13- |
| InChIKey | HPPZYQZGRIYOKL-DNSLJTBWSA-N |
| Molecular Weight | 222.332 g/mol |
| SMILES | N(C(N(C)C)=O)C12C[C@]3(C[C@](C[C@](C3)(C1)[H])(C2)[H])[H] |