| SpectraBase Compound ID | KftAtu7OglI |
|---|---|
| InChI | InChI=1S/C18H27N3O/c1-16-7-5-6-10-21(16)15-18(22)20-13-11-19(12-14-20)17-8-3-2-4-9-17/h2-4,8-9,16H,5-7,10-15H2,1H3 |
| InChIKey | LUAGHFHLRIJNDM-UHFFFAOYSA-N |
| Mol Weight | 301.43 g/mol |
| Molecular Formula | C18H27N3O |
| Exact Mass | 301.215413 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6hrkSmUjd3r |
|---|---|
| Name | 2-(2-Methyl-1-piperidinyl)-1-(4-phenyl-1-piperazinyl)ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.215412500 u |
| Formula | C18H27N3O |
| InChI | InChI=1S/C18H27N3O/c1-16-7-5-6-10-21(16)15-18(22)20-13-11-19(12-14-20)17-8-3-2-4-9-17/h2-4,8-9,16H,5-7,10-15H2,1H3 |
| InChIKey | LUAGHFHLRIJNDM-UHFFFAOYSA-N |
| SMILES | C=1C=C(C=CC1)N1CCN(CC1)C(CN1C(CCCC1)C)=O |