![p-Tolyl(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methanone](/api/spectrum/LG8dJnX7T0W/structure.png?h=300&w=458 "p-Tolyl(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methanone")
| SpectraBase Compound ID | 5cgpcVydHi5 |
|---|---|
| InChI | InChI=1S/C18H25NO/c1-13-5-7-14(8-6-13)16(20)19-12-18(4)10-15(19)9-17(2,3)11-18/h5-8,15H,9-12H2,1-4H3 |
| InChIKey | ZZOBWZDWULNDRG-UHFFFAOYSA-N |
| Mol Weight | 271.4 g/mol |
| Molecular Formula | C18H25NO |
| Exact Mass | 271.193614 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LG8dJnX7T0W |
|---|---|
| Name | p-Tolyl(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.193614428 u |
| Formula | C18H25NO |
| InChI | InChI=1S/C18H25NO/c1-13-5-7-14(8-6-13)16(20)19-12-18(4)10-15(19)9-17(2,3)11-18/h5-8,15H,9-12H2,1-4H3 |
| InChIKey | ZZOBWZDWULNDRG-UHFFFAOYSA-N |
| Molecular Weight | 271.404 g/mol |
| SMILES | C12(CN(C(C3=CC=C(C=C3)C)=O)C(C1)CC(C2)(C)C)C |