| SpectraBase Compound ID | Ci7GfdIyabA |
|---|---|
| InChI | InChI=1S/C18H28N2O/c1-4-5-6-12-20-13-8-11-16(20)18(21)19-17-14(2)9-7-10-15(17)3/h7,9-10,16H,4-6,8,11-13H2,1-3H3,(H,19,21) |
| InChIKey | QIBPVWGTPDOZLF-UHFFFAOYSA-N |
| Mol Weight | 288.44 g/mol |
| Molecular Formula | C18H28N2O |
| Exact Mass | 288.220164 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LBiCgS2MD6b |
|---|---|
| Name | N-(2,6-Dimethylphenyl)-1-pentylpyrrolidine-2-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.220163529 u |
| Formula | C18H28N2O |
| InChI | InChI=1S/C18H28N2O/c1-4-5-6-12-20-13-8-11-16(20)18(21)19-17-14(2)9-7-10-15(17)3/h7,9-10,16H,4-6,8,11-13H2,1-3H3,(H,19,21) |
| InChIKey | QIBPVWGTPDOZLF-UHFFFAOYSA-N |
| SMILES | C1C(N(CCCCC)CC1)C(NC1=C(C)C=CC=C1C)=O |