| SpectraBase Compound ID | JVxUEJBFSBT |
|---|---|
| InChI | InChI=1S/C14H21N3O/c1-11-5-3-4-6-13(11)17-9-7-16(8-10-17)12(2)14(15)18/h3-6,12H,7-10H2,1-2H3,(H2,15,18) |
| InChIKey | TUGJWMJXVZPDCN-UHFFFAOYSA-N |
| Mol Weight | 247.34 g/mol |
| Molecular Formula | C14H21N3O |
| Exact Mass | 247.168462 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EEKLkaf9Rgr |
|---|---|
| Name | alpha-Methyl-4-o-tolyl-1-piperazineacetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.168462307 u |
| Formula | C14H21N3O |
| InChI | InChI=1S/C14H21N3O/c1-11-5-3-4-6-13(11)17-9-7-16(8-10-17)12(2)14(15)18/h3-6,12H,7-10H2,1-2H3,(H2,15,18) |
| InChIKey | TUGJWMJXVZPDCN-UHFFFAOYSA-N |
| Molecular Weight | 247.342 g/mol |
| SMILES | NC(C(N1CCN(C2=CC=CC=C2C)CC1)C)=O |